2-amino-N-(2-methoxy-5-methylphenyl)acetamide

• ChemBase ID: 308374
• Molecular Formular: C10H14N2O2
• Molecular Mass: 194.23036
• Monoisotopic Mass: 194.1055277
• SMILES: c1(NC(=O)CN)c(ccc(c1)C)OC
• Canonical SMILES: NCC(=O)Nc1cc(C)ccc1OC
• InChI: InChI=1S/C10H14N2O2/c1-7-3-4-9(14-2)8(5-7)12-10(13)6-11/h3-5H,6,11H2,1-2H3,(H,12,13)
• InChIKey: SRFLDWOWAGQZAD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-N-(2-methoxy-5-methylphenyl)acetamide
• IUPAC Traditional name: 2-amino-N-(2-methoxy-5-methylphenyl)acetamide
• Synonyms: N~1~-(2-methoxy-5-methylphenyl)glycinamide

Database IDs

• CAS Number: 887359-06-0
• MDL Number: MFCD06662113

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -1.7304301
• LogD (pH = 7.4): -0.03611995
• Log P: 0.64257646
• Molar Refractivity: 55.7851 cm^3
• Polarizability: 21.017189 Å^3
• Polar Surface Area: 64.35 Å^2