Cas no 1279048-81-5 ((3S)-pyrrolidine-3-carboxamide hydrochloride)
(3S)-pyrrolidine-3-carboxamide hydrochloride Chemical and Physical Properties
Names and Identifiers
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- (S)-Pyrrolidine-3-carboxamide Hydrochloride
- (3S)-pyrrolidine-3-carboxamide,hydrochloride
- (3S)-pyrrolidine-3-carboxamide hydrochloride
- (S)-Pyrrolidine-3-carboxamide HCl
- AK165465
- 4853AJ
- PB28896
- AB0061790
- 3-Pyrrolidinecarboxamide, hydrochloride (1:1), (3S)-
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- MDL: MFCD22421737
- Inchi: 1S/C5H10N2O.ClH/c6-5(8)4-1-2-7-3-4;/h4,7H,1-3H2,(H2,6,8);1H/t4-;/m0./s1
- InChI Key: GCPFRHSIYOIWDY-WCCKRBBISA-N
- SMILES: Cl.O=C([C@@H]1CNCC1)N
Computed Properties
- Exact Mass: 150.05600
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 103
- Topological Polar Surface Area: 55.1
Experimental Properties
- PSA: 56.11000
- LogP: 1.36170
(3S)-pyrrolidine-3-carboxamide hydrochloride Security Information
- Signal Word:Warning
- Hazard Statement: H302-H315-H319-H335
- Warning Statement: P261-P305+P351+P338
- Storage Condition:Inert atmosphere,Room Temperature
(3S)-pyrrolidine-3-carboxamide hydrochloride Customs Data
- HS CODE:2933990090
- Customs Data:
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
(3S)-pyrrolidine-3-carboxamide hydrochloride Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A109005890-1g |
(S)-Pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 95% | 1g |
$722.25 | 2022-04-03 | |
| Alichem | A109005890-5g |
(S)-Pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 95% | 5g |
$2,316.60 | 2022-04-03 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | S173197-250mg |
(3S)-pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 97% | 250mg |
¥1527.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | S173197-500mg |
(3S)-pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 97% | 500mg |
¥2443.90 | 2023-09-01 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | S48300-250mg |
(S)-Pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 250mg |
¥2738.0 | 2021-09-04 | ||
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | D850614-250mg |
(S)-Pyrrolidine-3-carboxamide Hydrochloride |
1279048-81-5 | ≥95% | 250mg |
¥1,438.00 | 2022-01-10 | |
| Chemenu | CM106376-250mg |
(3S)-pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 95% | 250mg |
$201 | 2021-08-06 | |
| Chemenu | CM106376-1g |
(3S)-pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 95% | 1g |
$474 | 2021-08-06 | |
| TRC | P999945-10mg |
(S)-Pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 10mg |
$ 50.00 | 2022-06-03 | ||
| TRC | P999945-50mg |
(S)-Pyrrolidine-3-carboxamide hydrochloride |
1279048-81-5 | 50mg |
$ 160.00 | 2022-06-03 |
(3S)-pyrrolidine-3-carboxamide hydrochloride Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
Additional information on (3S)-pyrrolidine-3-carboxamide hydrochloride
Comprehensive Overview of (3S)-Pyrrolidine-3-carboxamide Hydrochloride (CAS No. 1279048-81-5): Properties, Applications, and Innovations
(3S)-Pyrrolidine-3-carboxamide hydrochloride (CAS No. 1279048-81-5) is a chiral organic compound with significant relevance in pharmaceutical research and fine chemical synthesis. This pyrrolidine derivative is characterized by its stereospecific (3S)-configuration, which plays a crucial role in its biological activity and synthetic utility. The compound's hydrochloride salt form enhances its solubility and stability, making it a preferred choice for drug development and biochemical studies.
Recent advancements in small molecule therapeutics have spurred interest in (3S)-pyrrolidine-3-carboxamide hydrochloride due to its structural versatility. Researchers are exploring its potential as a building block for protease inhibitors, neurological modulators, and anti-inflammatory agents. The compound's pyrrolidine core is a common motif in FDA-approved drugs, underscoring its importance in medicinal chemistry.
From a synthetic perspective, CAS 1279048-81-5 is often utilized in asymmetric catalysis and peptide mimetics. Its carboxamide group allows for facile derivatization, enabling the creation of diverse structure-activity relationship (SAR) libraries. This adaptability aligns with current trends in high-throughput screening and fragment-based drug design, addressing the growing demand for targeted therapies.
The pharmaceutical industry's shift toward personalized medicine has further elevated the significance of chiral compounds like (3S)-pyrrolidine-3-carboxamide hydrochloride. Its enantiomeric purity (typically >98% ee) meets stringent regulatory requirements for GMP manufacturing. Analytical techniques such as HPLC and chiral chromatography are routinely employed to verify its stereochemical integrity, reflecting the compound's role in quality-by-design (QbD) paradigms.
Environmental and safety considerations are paramount in modern chemical workflows. (3S)-Pyrrolidine-3-carboxamide hydrochloride exhibits favorable green chemistry metrics, with several synthetic routes employing biocatalysis or flow chemistry to minimize waste. These approaches resonate with the industry's focus on sustainable synthesis and carbon footprint reduction.
In the context of drug delivery systems, the hydrochloride salt form of this pyrrolidine carboxamide demonstrates improved bioavailability compared to its free base counterpart. This property is particularly valuable for oral formulations, where pH-dependent solubility often limits efficacy. Recent patent filings highlight its incorporation into modified-release matrices and co-crystals, addressing challenges in pharmacokinetic optimization.
The compound's mechanism of action frequently intersects with G-protein-coupled receptors (GPCRs) and ion channel modulation, making it a subject of interest in central nervous system (CNS) research. Preclinical studies suggest potential applications in neurodegenerative disorders and pain management, though further clinical validation is required.
From a commercial standpoint, CAS 1279048-81-5 is available through specialized fine chemical suppliers with strict quality control protocols. Pricing trends reflect its niche application spectrum, with bulk quantities typically reserved for contract research organizations (CROs) and pharmaceutical developers. The compound's intellectual property landscape shows increasing activity, particularly in composition-of-matter patents and process patents.
Emerging technologies like AI-assisted drug discovery are leveraging compounds such as (3S)-pyrrolidine-3-carboxamide hydrochloride to accelerate hit-to-lead optimization. Machine learning models trained on molecular descriptors can predict its interactions with biological targets, reducing experimental iterations. This synergy between computational chemistry and traditional synthesis exemplifies the compound's relevance in digital transformation initiatives.
Quality standards for 1279048-81-5 typically include specifications for residual solvents, heavy metals, and chromatographic purity, conforming to ICH guidelines. Stability studies indicate optimal storage conditions at controlled room temperature with protection from moisture, ensuring long-term viability for research applications.
In conclusion, (3S)-Pyrrolidine-3-carboxamide hydrochloride represents a versatile scaffold bridging academic research and industrial applications. Its stereochemical precision, synthetic flexibility, and therapeutic potential position it as a valuable asset in the evolving landscape of precision medicine and small molecule innovation.
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