Cas no 848192-93-8 (3-Cyclopropylazetidin-3-ol hydrochloride)

3-Cyclopropylazetidin-3-ol hydrochloride is a versatile heterocyclic compound featuring a cyclopropyl-substituted azetidine scaffold with a hydroxyl group at the 3-position. Its hydrochloride salt form enhances stability and solubility, making it suitable for synthetic applications in medicinal chemistry and pharmaceutical research. The strained azetidine ring and cyclopropyl moiety contribute to its utility as a building block for designing bioactive molecules, particularly in the development of enzyme inhibitors or receptor modulators. The presence of both hydroxyl and amine functional groups allows for further derivatization, enabling structural diversification. This compound is valued for its potential in probing structure-activity relationships in drug discovery.
3-Cyclopropylazetidin-3-ol hydrochloride structure
848192-93-8 structure
Product Name:3-Cyclopropylazetidin-3-ol hydrochloride
CAS No:848192-93-8
MF:C6H12ClNO
MW:149.618580818176
MDL:MFCD13248563
CID:706533
PubChem ID:46735150
Update Time:2025-06-29

3-Cyclopropylazetidin-3-ol hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclopropylazetidin-3-ol hydrochloride
    • 3-Azetidinol, 3-cyclopropyl-, hydrochloride
    • 3-Azetidinol,3-cyclopropyl-, hydrochloride (1:1)
    • 3-Cyclopropyl-3-hydroxyazetidine hydrochloride
    • 3-Cyclopropyl-3-azetidinol hydrochloride
    • 3-Cyclopropylazetidin-3-ol HCl
    • IOZOIHAUPARJOF-UHFFFAOYSA-N
    • 3-(Cyclopropyl)azetidin-3-ol HCl
    • PB16559
    • 3-cyclopropyl azetidin-3-ol hydrochloride
    • ST1010042
    • 3-Cyclopropylazetidin-3-ol--hydrogen chloride (1/1)
    • 3-Cyclopropyl-3-hydroxyaz...
    • 3-cyclopropylazetidin-3-ol
    • 3-Cyclopropyl-3-hydroxyazetidine hydrochloride 97%
    • SCHEMBL62939
    • YIB19293
    • AKOS006357873
    • CS-0051387
    • AS-34460
    • SY042320
    • EN300-126127
    • DB-014274
    • 3-cyclopropylazetidin-3-ol;hydrochloride
    • DTXSID50673748
    • 848192-93-8
    • 3-cyclopropylazetidin-3-olhydrochloride
    • MFCD13248563
    • MDL: MFCD13248563
    • Inchi: 1S/C6H11NO.ClH/c8-6(3-7-4-6)5-1-2-5;/h5,7-8H,1-4H2;1H
    • InChI Key: IOZOIHAUPARJOF-UHFFFAOYSA-N
    • SMILES: OC1(C2CC2)CNC1.Cl

Computed Properties

  • Exact Mass: 149.06100
  • Monoisotopic Mass: 149.061
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 105
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 32.299

Experimental Properties

  • PSA: 32.26000
  • LogP: 0.86150

3-Cyclopropylazetidin-3-ol hydrochloride Security Information

  • Storage Condition:Sealed in dry,Room Temperature

3-Cyclopropylazetidin-3-ol hydrochloride Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    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%

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Additional information on 3-Cyclopropylazetidin-3-ol hydrochloride

Professional Introduction to 3-Cyclopropylazetidin-3-ol Hydrochloride (CAS No. 848192-93-8)

3-Cyclopropylazetidin-3-ol hydrochloride, identified by the Chemical Abstracts Service Number (CAS No.) 848192-93-8, is a significant compound in the realm of pharmaceutical chemistry and medicinal research. This zwitterionic derivative has garnered attention due to its structural uniqueness and potential biological activities, making it a subject of extensive investigation in drug discovery and development.

The molecular framework of 3-cyclopropylazetidin-3-ol hydrochloride features a cyclopropyl substituent attached to an azetidine ring, which is further functionalized with a hydroxyl group at the 3-position. This specific arrangement imparts distinct steric and electronic properties, influencing its interactions with biological targets. The hydrochloride salt form enhances its solubility in aqueous media, facilitating its use in various biochemical assays and pharmacological studies.

In recent years, there has been growing interest in azetidine derivatives as scaffolds for developing novel therapeutic agents. The cyclopropyl moiety, in particular, has been shown to modulate the binding affinity and selectivity of small molecules toward enzymes and receptors. Studies have demonstrated that such structural motifs can improve pharmacokinetic profiles by enhancing metabolic stability and reducing off-target effects.

One of the most compelling aspects of 3-cyclopropylazetidin-3-ol hydrochloride is its potential as an intermediate in the synthesis of more complex pharmacophores. Researchers have leveraged this compound to explore its reactivity in cross-coupling reactions, allowing for the introduction of diverse functional groups while maintaining the core azetidine scaffold. This flexibility has enabled the creation of libraries of derivatives with tailored biological activities.

Recent advancements in computational chemistry have further illuminated the therapeutic potential of 3-cyclopropylazetidin-3-ol hydrochloride. Molecular docking simulations have identified its binding interactions with various protein targets, including kinases and transcription factors implicated in inflammatory and oncogenic pathways. These findings suggest that this compound may serve as a lead molecule for developing inhibitors with therapeutic relevance.

The synthesis of 3-cyclopropylazetidin-3-ol hydrochloride involves multi-step organic transformations, starting from readily available precursors. The introduction of the cyclopropyl group is typically achieved through ring-closing metathesis or cyclopropanation reactions, while the azetidine ring is constructed via intramolecular cyclization strategies. The final step involves salt formation with hydrochloric acid to enhance stability and handling properties.

Evaluation of 3-cyclopropylazetidin-3-ol hydrochloride in preclinical models has revealed promising results in terms of bioactivity and safety profiles. In vitro assays have shown inhibitory effects on several key enzymes, warranting further investigation into its mechanism of action. Additionally, preliminary toxicology studies indicate moderate solubility and low acute toxicity, suggesting a favorable safety profile for future clinical development.

The pharmaceutical industry continues to explore novel analogs of 3-cyclopropylazetidin-3-ol hydrochloride to optimize their pharmacological properties. By modifying substituents on the azetidine ring or introducing additional functional groups, researchers aim to enhance potency, selectivity, and oral bioavailability. These efforts are supported by high-throughput screening technologies that accelerate the identification of promising candidates for further development.

The role of 3-cyclopropylazetidin-3-ol hydrochloride as a building block in medicinal chemistry underscores its importance in drug discovery initiatives. Its unique structural features offer opportunities for designing molecules with improved pharmacological profiles compared to existing therapies. As research progresses, this compound is expected to contribute significantly to the development of new treatments for various diseases.

In conclusion, 3-cyclopropylazetidin-3-ol hydrochloride (CAS No. 848192-93-8) represents a valuable asset in pharmaceutical research due to its structural complexity and potential biological activities. Its synthesis, characterization, and preclinical evaluation continue to advance our understanding of azetidine derivatives as therapeutic agents. With ongoing investigations into its pharmacology and chemical modifications, this compound holds promise for future medical applications.

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