N,N-dipropylpiperidin-4-amine

• ChemBase ID: 74335
• Molecular Formular: C11H24N2
• Molecular Mass: 184.32166
• Monoisotopic Mass: 184.19394878
• SMILES: N(C1CCNCC1)(CCC)CCC
• Canonical SMILES: CCCN(C1CCNCC1)CCC
• InChI: InChI=1S/C11H24N2/c1-3-9-13(10-4-2)11-5-7-12-8-6-11/h11-12H,3-10H2,1-2H3
• InChIKey: TUANAYXZRKSRCV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N-dipropylpiperidin-4-amine
• IUPAC Traditional name: N,N-dipropylpiperidin-4-amine
• Synonyms: N,N-Dipropylpiperidin-4-amine; 4-(N,N-Dipropylamino)piperidine

Database IDs

• CAS Number: 675136-96-6
• MDL Number: MFCD04117822
• PubChem SID: 162039254
• PubChem CID: 3824021

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.4244204
• LogD (pH = 7.4): -2.5220277
• Log P: 1.5925883
• Molar Refractivity: 58.6897 cm^3
• Polarizability: 23.35114 Å^3
• Polar Surface Area: 15.27 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Harmful