2,6-diethyl-4-methylpyridin-3-ol

• ChemBase ID: 120433
• Molecular Formular: C10H15NO
• Molecular Mass: 165.2322
• Monoisotopic Mass: 165.11536411
• SMILES: n1c(c(c(cc1CC)C)O)CC
• Canonical SMILES: CCc1cc(C)c(c(n1)CC)O
• InChI: InChI=1S/C10H15NO/c1-4-8-6-7(3)10(12)9(5-2)11-8/h6,12H,4-5H2,1-3H3
• InChIKey: OJTCDHYFBRLNIN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,6-diethyl-4-methylpyridin-3-ol
• IUPAC Traditional name: 2,6-diethyl-4-methylpyridin-3-ol
• Synonyms: 2,6-diethyl-4-methylpyridin-3-ol

Database IDs

• PubChem SID: 162214786
• PubChem CID: 910447

CALCULATED PROPERTIES

• Acid pKa: 10.390279
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.1065007
• LogD (pH = 7.4): 2.4053695
• Log P: 2.6292415
• Molar Refractivity: 49.36 cm^3
• Polarizability: 19.010878 Å^3
• Polar Surface Area: 33.12 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true