dimethyl(piperidin-2-ylmethyl)amine

• ChemBase ID: 264790
• Molecular Formular: C8H18N2
• Molecular Mass: 142.24192
• Monoisotopic Mass: 142.14699859
• SMILES: N1C(CN(C)C)CCCC1
• Canonical SMILES: CN(CC1CCCCN1)C
• InChI: InChI=1S/C8H18N2/c1-10(2)7-8-5-3-4-6-9-8/h8-9H,3-7H2,1-2H3
• InChIKey: TVQYLBWVRBQOGI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dimethyl(piperidin-2-ylmethyl)amine
• IUPAC Traditional name: dimethyl(piperidin-2-ylmethyl)amine
• Synonyms: dimethyl(piperidin-2-ylmethyl)amine

Database IDs

• MDL Number: MFCD00023136
• PubChem SID: 164320700
• PubChem CID: 252484

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.7607002
• LogD (pH = 7.4): -1.8838081
• Log P: 0.73589927
• Molar Refractivity: 44.5247 cm^3
• Polarizability: 17.811394 Å^3
• Polar Surface Area: 15.27 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.201

Product Information

• Purity: 95%