N-(4-amino-2-methylphenyl)-2-(dimethylamino)acetamide

• ChemBase ID: 308183
• Molecular Formular: C11H17N3O
• Molecular Mass: 207.27218
• Monoisotopic Mass: 207.13716218
• SMILES: C(=O)(Nc1c(cc(N)cc1)C)CN(C)C
• Canonical SMILES: CN(CC(=O)Nc1ccc(cc1C)N)C
• InChI: InChI=1S/C11H17N3O/c1-8-6-9(12)4-5-10(8)13-11(15)7-14(2)3/h4-6H,7,12H2,1-3H3,(H,13,15)
• InChIKey: SRHDPFHMZSFGLP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-(4-amino-2-methylphenyl)-2-(dimethylamino)acetamide
• IUPAC Traditional name: N-(4-amino-2-methylphenyl)-2-(dimethylamino)acetamide
• Synonyms: N~1~-(4-amino-2-methylphenyl)-N~2~,N~2~-dimethylglycinamide

Database IDs

• CAS Number: 83473-61-4
• MDL Number: MFCD09738929

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -0.9941908
• LogD (pH = 7.4): 0.54951274
• Log P: 0.7869501
• Molar Refractivity: 64.0916 cm^3
• Polarizability: 23.320099 Å^3
• Polar Surface Area: 58.36 Å^2