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

• ChemBase ID: 282263
• Molecular Formular: C8H13N3
• Molecular Mass: 151.20892
• Monoisotopic Mass: 151.11094743
• SMILES: n12c(ncc1CN)CCCC2
• Canonical SMILES: NCc1cnc2n1CCCC2
• InChI: InChI=1S/C8H13N3/c9-5-7-6-10-8-3-1-2-4-11(7)8/h6H,1-5,9H2
• InChIKey: JEZRDACHQQVYIB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

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

Database IDs

• MDL Number: MFCD17480537
• PubChem SID: 180667794
• PubChem CID: 50989750

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.4209874
• LogD (pH = 7.4): -1.4662998
• Log P: -0.081142224
• Molar Refractivity: 44.1974 cm^3
• Polarizability: 16.98317 Å^3
• Polar Surface Area: 43.84 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.218

Product Information

• Purity: 95%