1-(6-methylpyridin-2-yl)propan-2-amine

• ChemBase ID: 306474
• Molecular Formular: C9H14N2
• Molecular Mass: 150.22086
• Monoisotopic Mass: 150.11569846
• SMILES: n1c(CC(N)C)cccc1C
• Canonical SMILES: CC(Cc1cccc(n1)C)N
• InChI: InChI=1S/C9H14N2/c1-7(10)6-9-5-3-4-8(2)11-9/h3-5,7H,6,10H2,1-2H3
• InChIKey: JFGRQKKIRKOYSB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(6-methylpyridin-2-yl)propan-2-amine
• IUPAC Traditional name: 1-(6-methylpyridin-2-yl)propan-2-amine
• Synonyms: 1-(6-methylpyridin-2-yl)propan-2-amine

Database IDs

• CAS Number: 71271-62-0
• MDL Number: MFCD08452689

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.3225112
• LogD (pH = 7.4): -1.5921285
• Log P: 0.7477716
• Molar Refractivity: 45.562 cm^3
• Polarizability: 18.187363 Å^3
• Polar Surface Area: 38.91 Å^2