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CS-W001157 4
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3-Azabicyclo[3.3.0]octane hydrochloride

  • CAS No. 112626-50-3

  • Cat. No. CS-D1515
  • Molecule weight147.65
  • Purity≥98%
  • MDL No.MFCD06411019

*For research and further manufacturing use only, not for direct human use.

3-Azabicyclo[3.3.0]octane hydrochloride|CS-D1515

Structure of 112626-50-3

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General Information

  • CAS No. 112626-50-3
  • Cat. No. CS-D1515
  • Purity ≥98%
  • MDL No. MFCD06411019
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₄ClN
  • Molecular Weight 147.65
  • Synonym(s) Octahydrocyclopenta[c]pyrrole hydrochloride; 3-Azabicyclo[3,3,0]octane hydrochloride; 3-Azabicyclo[3.3.0]octane hydrochloride
  • SMILES [H]Cl.C12CNCC1CCC2

Description

3-Azabicyclo[3.3.0]octane hydrochloride offers a rigid, nitrogen-containing scaffold ideal for probing bioactive conformation in medicinal chemistry. This bench-stable salt features enhanced solubility and predictable protonation behavior, enabling efficient incorporation into target-oriented synthesis and structure-activity studies.

Application

3-Azabicyclo[3.3.0]octane hydrochloride serves as a conformationally constrained nitrogen heterocycle widely employed in medicinal chemistry for scaffold hopping and target engagement studies. Its rigid bicyclic framework imparts defined spatial orientation to substituents, enhancing binding selectivity. The hydrochloride salt ensures excellent solubility and stability under standard handling conditions, enabling straightforward incorporation into peptide-like molecules, kinase inhibitors, and GPCR-targeted ligands via standard amine functionalization protocols.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   12.03
  • LogP   1.4277
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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