methyl 3-methoxyimidazo[1,2-a]pyridine-2-carboxylate

• ChemBase ID: 124932
• Molecular Formular: C10H10N2O3
• Molecular Mass: 206.198
• Monoisotopic Mass: 206.06914219
• SMILES: c1(c(n2c(n1)cccc2)OC)C(=O)OC
• Canonical SMILES: COC(=O)c1nc2n(c1OC)cccc2
• InChI: InChI=1S/C10H10N2O3/c1-14-9-8(10(13)15-2)11-7-5-3-4-6-12(7)9/h3-6H,1-2H3
• InChIKey: CVBCOOHLVIZJES-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl 3-methoxyimidazo[1,2-a]pyridine-2-carboxylate
• IUPAC Traditional name: methyl 3-methoxyimidazo[1,2-a]pyridine-2-carboxylate
• Synonyms: methyl 3-methoxyimidazo[1,2-a]pyridine-2-carboxylate

Database IDs

• PubChem SID: 162219285
• PubChem CID: 8033665

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 0.8779272
• LogD (pH = 7.4): 0.880464
• Log P: 0.88049644
• Molar Refractivity: 53.3062 cm^3
• Polarizability: 20.282745 Å^3
• Polar Surface Area: 52.83 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true