1-cyclopentylpiperidin-4-amine

• ChemBase ID: 255440
• Molecular Formular: C10H20N2
• Molecular Mass: 168.2792
• Monoisotopic Mass: 168.16264865
• SMILES: N1(CCC(CC1)N)C1CCCC1
• Canonical SMILES: NC1CCN(CC1)C1CCCC1
• InChI: InChI=1S/C10H20N2/c11-9-5-7-12(8-6-9)10-3-1-2-4-10/h9-10H,1-8,11H2
• InChIKey: HJJXAKRPWXVQGP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-cyclopentylpiperidin-4-amine
• IUPAC Traditional name: 1-cyclopentylpiperidin-4-amine
• Synonyms: 1-cyclopentyl-4-piperidinamine; 1-cyclopentylpiperidin-4-amine

Database IDs

• CAS Number: 132740-50-2
• MDL Number: MFCD06740673
• PubChem SID: 164311350
• PubChem CID: 4778240

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -5.0223126
• LogD (pH = 7.4): -3.036741
• Log P: 0.75604916
• Molar Refractivity: 51.7831 cm^3
• Polarizability: 20.7646 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.606

Product Information

• Purity: 95%