2-amino-N-(2-ethylphenyl)benzamide

• ChemBase ID: 312345
• Molecular Formular: C15H16N2O
• Molecular Mass: 240.30034
• Monoisotopic Mass: 240.12626314
• SMILES: C(=O)(c1c(N)cccc1)Nc1c(CC)cccc1
• Canonical SMILES: CCc1ccccc1NC(=O)c1ccccc1N
• InChI: InChI=1S/C15H16N2O/c1-2-11-7-3-6-10-14(11)17-15(18)12-8-4-5-9-13(12)16/h3-10H,2,16H2,1H3,(H,17,18)
• InChIKey: BKOXJFYOTZYOLL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-N-(2-ethylphenyl)benzamide
• IUPAC Traditional name: 2-amino-N-(2-ethylphenyl)benzamide
• Synonyms: 2-amino-N-(2-ethylphenyl)benzamide

Database IDs

• CAS Number: 19562-50-6
• MDL Number: MFCD03166496

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 3.8438382
• LogD (pH = 7.4): 3.8441901
• Log P: 3.8441947
• Molar Refractivity: 75.9341 cm^3
• Polarizability: 27.695484 Å^3
• Polar Surface Area: 55.12 Å^2