Cas no 1220019-14-6 (2-Amino-N-(sec-butyl)acetamide hydrochloride)
2-Amino-N-(sec-butyl)acetamide hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 2-Amino-N-(sec-butyl)acetamide hydrochloride
- AKOS015847602
- 1220019-14-6
- 2-AMINO-N-(SEC-BUTYL)ACETAMIDEHYDROCHLORIDE
- A925861
- 2-amino-N-butan-2-ylacetamide;hydrochloride
- 2-amino-N-(butan-2-yl)acetamide hydrochloride
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- MDL: MFCD13562452
- Inchi: 1S/C6H14N2O.ClH/c1-3-5(2)8-6(9)4-7;/h5H,3-4,7H2,1-2H3,(H,8,9);1H
- InChI Key: QZEPMKVWIJNEFN-UHFFFAOYSA-N
- SMILES: Cl.O=C(CN)NC(C)CC
Computed Properties
- Exact Mass: 166.0872908g/mol
- Monoisotopic Mass: 166.0872908g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 93.1
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 55.1?2
2-Amino-N-(sec-butyl)acetamide hydrochloride Security Information
- Storage Condition:Sealed in dry,Room Temperature
2-Amino-N-(sec-butyl)acetamide hydrochloride Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Ambeed | A210763-1g |
2-Amino-N-(sec-butyl)acetamide hydrochloride |
1220019-14-6 | 95+% | 1g |
$168.0 | 2024-04-25 | |
| Ambeed | A210763-5g |
2-Amino-N-(sec-butyl)acetamide hydrochloride |
1220019-14-6 | 95+% | 5g |
$504.0 | 2024-04-25 |
2-Amino-N-(sec-butyl)acetamide hydrochloride Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
Additional information on 2-Amino-N-(sec-butyl)acetamide hydrochloride
Introduction to 2-Amino-N-(sec-butyl)acetamide hydrochloride (CAS No. 1220019-14-6)
2-Amino-N-(sec-butyl)acetamide hydrochloride, identified by its CAS number 1220019-14-6, is a compound of significant interest in the field of pharmaceutical chemistry and bioorganic synthesis. This amide derivative, featuring a sec-butyl group and an amino functional group, has garnered attention due to its structural versatility and potential applications in medicinal chemistry. The hydrochloride salt form enhances its solubility, making it a valuable intermediate in the synthesis of more complex molecules.
The compound belongs to the broader class of amides, which are ubiquitous in biological systems and pharmaceuticals. Amides are known for their stability and ability to participate in hydrogen bonding, making them integral to the design of bioactive molecules. The sec-butyl substituent in 2-amino-N-(sec-butyl)acetamide hydrochloride introduces steric bulk and influences the compound's pharmacokinetic properties, which are critical factors in drug development.
In recent years, there has been a surge in research focused on developing novel amide-based therapeutics due to their favorable pharmacological profiles. For instance, studies have highlighted the role of amides in modulating enzyme activity and receptor interactions. The sec-butyl group, in particular, has been explored for its ability to fine-tune molecular interactions, thereby enhancing binding affinity and selectivity. This has led to its incorporation into various drug candidates targeting neurological disorders, inflammatory conditions, and infectious diseases.
One of the most compelling aspects of 2-amino-N-(sec-butyl)acetamide hydrochloride is its utility as a building block in synthetic chemistry. Its structural framework allows for facile modifications at multiple positions, enabling the creation of libraries of derivatives with tailored properties. This flexibility is particularly valuable in high-throughput screening programs aimed at identifying lead compounds for further development.
Recent advancements in computational chemistry have further enhanced the understanding of how structural features like the sec-butyl group influence biological activity. Molecular modeling studies have demonstrated that this substituent can optimize binding interactions by adjusting the distance and orientation of key functional groups within the target protein or nucleic acid. Such insights are instrumental in rational drug design, where small changes in molecular structure can lead to significant improvements in therapeutic efficacy.
The synthesis of 2-amino-N-(sec-butyl)acetamide hydrochloride typically involves multi-step reactions starting from readily available precursors. Common synthetic routes include nucleophilic substitution reactions followed by amidation steps. The hydrochloride salt is formed by treating the free base with hydrochloric acid, which not only improves solubility but also enhances stability during storage and handling.
In industrial settings, process optimization is crucial for ensuring high yields and purity levels. Continuous flow chemistry has emerged as a powerful tool for synthesizing complex molecules like 2-amino-N-(sec-butyl)acetamide hydrochloride efficiently. This approach offers advantages such as improved scalability, reduced reaction times, and minimized waste generation—a critical consideration in sustainable chemical manufacturing.
The pharmaceutical industry has shown particular interest in amides due to their role as pharmacophores in numerous FDA-approved drugs. For example, derivatives of this class have been investigated for their potential as kinase inhibitors, protease inhibitors, and antiviral agents. The sec-butyl group's influence on electronic properties also makes it useful for modulating metabolic stability and improving oral bioavailability.
Regulatory considerations play a significant role in the development and commercialization of pharmaceutical compounds like 2-amino-N-(sec-butyl)acetamide hydrochloride. Compliance with Good Manufacturing Practices (GMP) ensures that the final product meets stringent quality standards before reaching clinical trials or market distribution. Analytical techniques such as HPLC (High-Performance Liquid Chromatography), NMR (Nuclear Magnetic Resonance), and mass spectrometry are employed to verify purity and identity throughout the manufacturing process.
As research continues to uncover new therapeutic applications for amides, compounds like 2-amino-N-(sec-butyl)acetamide hydrochloride are likely to play an increasingly important role in drug discovery pipelines. Collaborative efforts between academic researchers and industry scientists will be essential to translate these findings into tangible benefits for patients worldwide.
The future direction of research may also explore green chemistry approaches to synthesizing such compounds using renewable feedstocks or biocatalytic methods. These innovations align with global efforts to reduce environmental impact while maintaining high standards of chemical synthesis efficiency.
In conclusion,2-amino-N-(sec-butyl)acetamide hydrochloride (CAS No. 1220019-14-6) represents a promising candidate for further exploration in pharmaceutical research due to its structural features and synthetic accessibility. Its potential applications span multiple therapeutic areas, making it a valuable asset for medicinal chemists seeking novel molecular scaffolds.
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