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

• ChemBase ID: 66706
• Molecular Formular: C8H10ClN3
• Molecular Mass: 183.6381
• Monoisotopic Mass: 183.05632502
• SMILES: Nc1c2n(ccc1)cc(n2)C.Cl
• Canonical SMILES: Cc1cn2c(n1)c(N)ccc2.Cl
• InChI: InChI=1S/C8H9N3.ClH/c1-6-5-11-4-2-3-7(9)8(11)10-6;/h2-5H,9H2,1H3;1H
• InChIKey: KAHZHPQAMUDHSL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methylimidazo[1,2-a]pyridin-8-amine hydrochloride
• IUPAC Traditional name: 2-methylimidazo[1,2-a]pyridin-8-amine hydrochloride
• Synonyms: 2-Methylimidazo[1,2-a]pyridin-8-ylamine hydrochloride

Database IDs

• CAS Number: 173159-45-0
• MDL Number: MFCD07367043
• PubChem SID: 162032442
• PubChem CID: 45789648

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -1.0989654
• LogD (pH = 7.4): -0.04550089
• Log P: 0.06199364
• Molar Refractivity: 45.2283 cm^3
• Polarizability: 16.18626 Å^3
• Polar Surface Area: 43.32 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95+%