(E)-N,N'-diphenylethenimidamide

• ChemBase ID: 58392
• Molecular Formular: C14H14N2
• Molecular Mass: 210.27436
• Monoisotopic Mass: 210.11569846
• SMILES: C/C(=N\c1ccccc1)/Nc1ccccc1
• Canonical SMILES: C/C(=N\c1ccccc1)/Nc1ccccc1
• InChI: InChI=1S/C14H14N2/c1-12(15-13-8-4-2-5-9-13)16-14-10-6-3-7-11-14/h2-11H,1H3,(H,15,16)
• InChIKey: CLWIJUQLAFJNOF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (E)-N,N'-diphenylethenimidamide
• IUPAC Traditional name: (E)-N,N'-diphenylethenimidamide
• Synonyms: (1E)-N,N'-Diphenylethanimidamide

Database IDs

• MDL Number: MFCD00137802
• PubChem SID: 162063155
• PubChem CID: 12117

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.5512475
• LogD (pH = 7.4): 2.5336754
• Log P: 3.2727149
• Molar Refractivity: 69.6666 cm^3
• Polarizability: 25.503025 Å^3
• Polar Surface Area: 24.39 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false