[1,3]oxazolo[4,5-b]pyridin-2-amine

• ChemBase ID: 308630
• Molecular Formular: C6H5N3O
• Molecular Mass: 135.1234
• Monoisotopic Mass: 135.0432618
• SMILES: n1c(oc2c1nccc2)N
• Canonical SMILES: Nc1nc2c(o1)cccn2
• InChI: InChI=1S/C6H5N3O/c7-6-9-5-4(10-6)2-1-3-8-5/h1-3H,(H2,7,8,9)
• InChIKey: AVSYPWBWFBPSEU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [1,3]oxazolo[4,5-b]pyridin-2-amine
• IUPAC Traditional name: [1,3]oxazolo[4,5-b]pyridin-2-amine
• Synonyms: [1,3]oxazolo[4,5-b]pyridin-2-amine

Database IDs

• CAS Number: 40926-66-7
• MDL Number: MFCD11110210

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 0.28252113
• LogD (pH = 7.4): 0.28252152
• Log P: 0.28252158
• Molar Refractivity: 36.3127 cm^3
• Polarizability: 13.420123 Å^3
• Polar Surface Area: 64.94 Å^2