8-methylimidazo[1,2-a]pyridin-3-amine

• ChemBase ID: 160294
• Molecular Formular: C8H9N3
• Molecular Mass: 147.17716
• Monoisotopic Mass: 147.0796473
• SMILES: c1ccc(c2n1c(cn2)N)C
• Canonical SMILES: Cc1cccn2c1ncc2N
• InChI: InChI=1S/C8H9N3/c1-6-3-2-4-11-7(9)5-10-8(6)11/h2-5H,9H2,1H3
• InChIKey: GGGMCFYRIGTEMG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 8-methylimidazo[1,2-a]pyridin-3-amine
• IUPAC Traditional name: 8-methylimidazo[1,2-a]pyridin-3-amine
• Synonyms: 8-Methyl-imidazo[1,2-a]pyridin-3-amine; 3-Amino-8-methylimidazo[1,2-a]pyridine

Database IDs

• CAS Number: 68739-11-7
• PubChem SID: 162254429
• PubChem CID: 12913350

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.53134334
• LogD (pH = 7.4): -0.14058149
• Log P: 0.53333586
• Molar Refractivity: 44.9313 cm^3
• Polarizability: 16.179237 Å^3
• Polar Surface Area: 43.32 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Dichloromethane; Ethanol; Ethyl Acetate; Methanol
• Apperance: Brown Solid
• Melting Point: 95-97°C

Safety Information

• Storage Condition: Refrigerator