N-cyclopentylpyridin-4-amine

• ChemBase ID: 237054
• Molecular Formular: C10H14N2
• Molecular Mass: 162.23156
• Monoisotopic Mass: 162.11569846
• SMILES: N(c1ccncc1)C1CCCC1
• Canonical SMILES: C1CCC(C1)Nc1ccncc1
• InChI: InChI=1S/C10H14N2/c1-2-4-9(3-1)12-10-5-7-11-8-6-10/h5-9H,1-4H2,(H,11,12)
• InChIKey: ZYPKTMZFRMKZMM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-cyclopentylpyridin-4-amine
• IUPAC Traditional name: N-cyclopentylpyridin-4-amine
• Synonyms: N-cyclopentylpyridin-4-amine

Database IDs

• MDL Number: MFCD11116882
• PubChem SID: 164292964
• PubChem CID: 20497572

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 0.5995931
• LogD (pH = 7.4): 0.72011673
• Log P: 1.5830534
• Molar Refractivity: 50.5081 cm^3
• Polarizability: 19.051504 Å^3
• Polar Surface Area: 24.92 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.588

Product Information

• Purity: 95%