{5,7-dimethylimidazo[1,2-a]pyridin-2-yl}methanamine

• ChemBase ID: 306693
• Molecular Formular: C10H13N3
• Molecular Mass: 175.23032
• Monoisotopic Mass: 175.11094743
• SMILES: c12n(c(cc(c2)C)C)cc(n1)CN
• Canonical SMILES: NCc1cn2c(n1)cc(cc2C)C
• InChI: InChI=1S/C10H13N3/c1-7-3-8(2)13-6-9(5-11)12-10(13)4-7/h3-4,6H,5,11H2,1-2H3
• InChIKey: SKGZYIOXRGOANX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {5,7-dimethylimidazo[1,2-a]pyridin-2-yl}methanamine
• IUPAC Traditional name: {5,7-dimethylimidazo[1,2-a]pyridin-2-yl}methanamine
• Synonyms: 1-(5,7-dimethylimidazo[1,2-a]pyridin-2-yl)methanamine

Database IDs

• CAS Number: 1083267-42-8
• MDL Number: MFCD16556106

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.0978317
• LogD (pH = 7.4): -0.5370452
• Log P: 0.67977244
• Molar Refractivity: 54.0785 cm^3
• Polarizability: 20.18373 Å^3
• Polar Surface Area: 43.32 Å^2