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

• ChemBase ID: 284365
• Molecular Formular: C8H13N3
• Molecular Mass: 151.20892
• Monoisotopic Mass: 151.11094743
• SMILES: c12n(ccn1)CCCC2CN
• Canonical SMILES: NCC1CCCn2c1ncc2
• InChI: InChI=1S/C8H13N3/c9-6-7-2-1-4-11-5-3-10-8(7)11/h3,5,7H,1-2,4,6,9H2
• InChIKey: HUQMVCUMAXSLJG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

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

Database IDs

• MDL Number: MFCD22578754
• PubChem SID: 180669896
• PubChem CID: 73994630

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.705322
• LogD (pH = 7.4): -2.2201982
• Log P: 0.028421544
• Molar Refractivity: 43.8532 cm^3
• Polarizability: 16.98557 Å^3
• Polar Surface Area: 43.84 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.388

Product Information

• Purity: 95%