2-(cyclopentyloxy)cyclohexan-1-amine hydrochloride

• ChemBase ID: 243340
• Molecular Formular: C11H22ClNO
• Molecular Mass: 219.75148
• Monoisotopic Mass: 219.13899201
• SMILES: O(C1C(N)CCCC1)C1CCCC1.Cl
• Canonical SMILES: NC1CCCCC1OC1CCCC1.Cl
• InChI: InChI=1S/C11H21NO.ClH/c12-10-7-3-4-8-11(10)13-9-5-1-2-6-9;/h9-11H,1-8,12H2;1H
• InChIKey: GXAQSQURZJEPMW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(cyclopentyloxy)cyclohexan-1-amine hydrochloride
• IUPAC Traditional name: 2-(cyclopentyloxy)cyclohexan-1-amine hydrochloride
• Synonyms: 2-(cyclopentyloxy)cyclohexan-1-amine hydrochloride

Database IDs

• MDL Number: MFCD22578648
• PubChem SID: 164299250
• PubChem CID: 71757225

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.9121428
• LogD (pH = 7.4): -0.19285336
• Log P: 2.0967364
• Molar Refractivity: 53.4589 cm^3
• Polarizability: 21.75466 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.202

Product Information

• Purity: 95%