5H,6H,7H,8H-imidazo[1,2-a]pyridin-3-amine

• ChemBase ID: 282595
• Molecular Formular: C7H11N3
• Molecular Mass: 137.18234
• Monoisotopic Mass: 137.09529737
• SMILES: n12c(cnc1CCCC2)N
• Canonical SMILES: Nc1cnc2n1CCCC2
• InChI: InChI=1S/C7H11N3/c8-6-5-9-7-3-1-2-4-10(6)7/h5H,1-4,8H2
• InChIKey: UEFVKXYRGZDERM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5H,6H,7H,8H-imidazo[1,2-a]pyridin-3-amine
• IUPAC Traditional name: 5H,6H,7H,8H-imidazo[1,2-a]pyridin-3-amine
• Synonyms: 5H,6H,7H,8H-imidazo[1,2-a]pyridin-3-amine; 5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-amine

Database IDs

• CAS Number: 1177321-97-9
• MDL Number: MFCD09971204
• PubChem SID: 180668126
• PubChem CID: 28064418

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.9348435
• LogD (pH = 7.4): -0.64308244
• Log P: 0.13345328
• Molar Refractivity: 39.8002 cm^3
• Polarizability: 14.761686 Å^3
• Polar Surface Area: 43.84 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.545

Product Information

• Purity: 95%