4-cyclopentylpiperidine hydrochloride

• ChemBase ID: 283909
• Molecular Formular: C10H20ClN
• Molecular Mass: 189.7255
• Monoisotopic Mass: 189.12842733
• SMILES: N1CCC(C2CCCC2)CC1.Cl
• Canonical SMILES: N1CCC(CC1)C1CCCC1.Cl
• InChI: InChI=1S/C10H19N.ClH/c1-2-4-9(3-1)10-5-7-11-8-6-10;/h9-11H,1-8H2;1H
• InChIKey: SYJVZAIQSBNWJW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-cyclopentylpiperidine hydrochloride
• IUPAC Traditional name: 4-cyclopentylpiperidine hydrochloride
• Synonyms: 4-cyclopentylpiperidine hydrochloride

Database IDs

• MDL Number: MFCD20502015
• PubChem SID: 180669440
• PubChem CID: 54595789

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.1300626
• LogD (pH = 7.4): -0.67321384
• Log P: 2.101506
• Molar Refractivity: 47.9334 cm^3
• Polarizability: 19.244478 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.926

Product Information

• Purity: 95%