4-(cyclopentyloxy)piperidine hydrochloride

• ChemBase ID: 266870
• Molecular Formular: C10H20ClNO
• Molecular Mass: 205.7249
• Monoisotopic Mass: 205.12334195
• SMILES: N1CCC(OC2CCCC2)CC1.Cl
• Canonical SMILES: N1CCC(CC1)OC1CCCC1.Cl
• InChI: InChI=1S/C10H19NO.ClH/c1-2-4-9(3-1)12-10-5-7-11-8-6-10;/h9-11H,1-8H2;1H
• InChIKey: OQYXOEXWHVWKKM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-(cyclopentyloxy)piperidine hydrochloride
• IUPAC Traditional name: 4-(cyclopentyloxy)piperidine hydrochloride
• Synonyms: 4-(cyclopentyloxy)piperidine hydrochloride

Database IDs

• MDL Number: MFCD16040080
• PubChem SID: 164322780
• PubChem CID: 47002855

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.0969245
• LogD (pH = 7.4): -1.4085027
• Log P: 1.1230094
• Molar Refractivity: 49.5821 cm^3
• Polarizability: 19.910645 Å^3
• Polar Surface Area: 21.26 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 218 - 220°C
• Hydrophobicity(logP): 0.896

Product Information

• Purity: 95%