2-methoxy-6-methylpyridin-3-amine

• ChemBase ID: 67980
• Molecular Formular: C7H10N2O
• Molecular Mass: 138.1671
• Monoisotopic Mass: 138.07931295
• SMILES: c1(c(ccc(n1)C)N)OC
• Canonical SMILES: COc1nc(C)ccc1N
• InChI: InChI=1S/C7H10N2O/c1-5-3-4-6(8)7(9-5)10-2/h3-4H,8H2,1-2H3
• InChIKey: PCFDAJOZHXUBES-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methoxy-6-methylpyridin-3-amine
• IUPAC Traditional name: 2-methoxy-6-methylpyridin-3-amine
• Synonyms: 3-Amino-2-methoxy-6-picoline

Database IDs

• CAS Number: 186413-79-6
• MDL Number: MFCD03095079
• PubChem SID: 162033712
• PubChem CID: 10606805

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 0.48156005
• LogD (pH = 7.4): 0.49463454
• Log P: 0.49480388
• Molar Refractivity: 39.9697 cm^3
• Polarizability: 14.857972 Å^3
• Polar Surface Area: 48.14 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95+%