5H,6H,7H,8H-imidazo[1,2-a]pyridine

• ChemBase ID: 285229
• Molecular Formular: C7H10N2
• Molecular Mass: 122.1677
• Monoisotopic Mass: 122.08439833
• SMILES: n12c(ncc1)CCCC2
• Canonical SMILES: C1CCc2n(C1)ccn2
• InChI: InChI=1S/C7H10N2/c1-2-5-9-6-4-8-7(9)3-1/h4,6H,1-3,5H2
• InChIKey: PPRGXYWEHFENBY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5H,6H,7H,8H-imidazo[1,2-a]pyridine
• IUPAC Traditional name: 5H,6H,7H,8H-imidazo[1,2-a]pyridine
• Synonyms: 5H,6H,7H,8H-imidazo[1,2-a]pyridine

Database IDs

• MDL Number: MFCD11849324
• PubChem SID: 180670760
• PubChem CID: 9989264

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.116811804
• LogD (pH = 7.4): 0.6842999
• Log P: 0.87308824
• Molar Refractivity: 35.8465 cm^3
• Polarizability: 13.617756 Å^3
• Polar Surface Area: 17.82 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.83

Product Information

• Purity: 95%