N-acetyl-N-(benzyloxy)-2-phenylacetamide

• ChemBase ID: 798035
• Molecular Formular: C17H17NO3
• Molecular Mass: 283.32178
• Monoisotopic Mass: 283.12084341
• SMILES: CC(=O)N(C(=O)Cc1ccccc1)OCc1ccccc1
• Canonical SMILES: CC(=O)N(C(=O)Cc1ccccc1)OCc1ccccc1
• InChI: InChI=1S/C17H17NO3/c1-14(19)18(21-13-16-10-6-3-7-11-16)17(20)12-15-8-4-2-5-9-15/h2-11H,12-13H2,1H3
• InChIKey: DXKWHGABTPAPQL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-acetyl-N-(benzyloxy)-2-phenylacetamide
• IUPAC Traditional name: N-acetyl-N-(benzyloxy)-2-phenylacetamide
• Synonyms: N-Benzyloxy-N-phenylacetyl-acetamide

Database IDs

• CAS Number: 22426-99-9

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 2.891912
• LogD (pH = 7.4): 2.891912
• Log P: 2.891912
• Molar Refractivity: 79.6132 cm^3
• Polarizability: 31.095509 Å^3
• Polar Surface Area: 46.61 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%