[1-(piperidin-1-yl)cyclopentyl]methanamine

• ChemBase ID: 33044
• Molecular Formular: C11H22N2
• Molecular Mass: 182.30578
• Monoisotopic Mass: 182.17829871
• SMILES: N1(C2(CN)CCCC2)CCCCC1
• Canonical SMILES: NCC1(CCCC1)N1CCCCC1
• InChI: InChI=1S/C11H22N2/c12-10-11(6-2-3-7-11)13-8-4-1-5-9-13/h1-10,12H2
• InChIKey: KEDRZSDDGPZNTE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [1-(piperidin-1-yl)cyclopentyl]methanamine
• IUPAC Traditional name: [1-(piperidin-1-yl)cyclopentyl]methanamine
• Synonyms: 1-(1-piperidin-1-ylcyclopentyl)methanamine; (1-Piperidin-1-ylcyclopentyl)methylamine

Database IDs

• CAS Number: 933701-05-4
• MDL Number: MFCD09055382
• PubChem SID: 160996351
• PubChem CID: 24708164

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.4916003
• LogD (pH = 7.4): -1.4848055
• Log P: 1.5220224
• Molar Refractivity: 56.3827 cm^3
• Polarizability: 22.610828 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false