2-chlorocyclopentan-1-amine

• ChemBase ID: 80390
• Molecular Formular: C5H10ClN
• Molecular Mass: 119.5926
• Monoisotopic Mass: 119.05017701
• SMILES: NC1C(Cl)CCC1
• Canonical SMILES: ClC1CCCC1N
• InChI: InChI=1S/C5H10ClN/c6-4-2-1-3-5(4)7/h4-5H,1-3,7H2
• InChIKey: ZRECJZKXOKWRRT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-chlorocyclopentan-1-amine
• IUPAC Traditional name: 2-chlorocyclopentan-1-amine
• Synonyms: 2-chlorocyclopentylamine

Database IDs

• MDL Number: MFCD00177944
• PubChem SID: 162067510
• PubChem CID: 2776072

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.9719967
• LogD (pH = 7.4): -0.98084915
• Log P: 1.0089313
• Molar Refractivity: 30.7445 cm^3
• Polarizability: 12.560691 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true