N,6-dimethyl-N-[(2E)-3-phenylprop-2-en-1-yl]imidazo[1,2-a]pyridine-2-carboxamide

• ChemBase ID: 779838
• Molecular Formular: C19H19N3O
• Molecular Mass: 305.37366
• Monoisotopic Mass: 305.15281224
• SMILES: c1(nc2n(c1)cc(cc2)C)C(=O)N(C/C=C/c1ccccc1)C
• Canonical SMILES: Cc1ccc2n(c1)cc(n2)C(=O)N(C/C=C/c1ccccc1)C
• InChI: InChI=1S/C19H19N3O/c1-15-10-11-18-20-17(14-22(18)13-15)19(23)21(2)12-6-9-16-7-4-3-5-8-16/h3-11,13-14H,12H2,1-2H3/b9-6+
• InChIKey: LBKPVJJTWXAXPU-RMKNXTFCSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,6-dimethyl-N-[(2E)-3-phenylprop-2-en-1-yl]imidazo[1,2-a]pyridine-2-carboxamide
• IUPAC Traditional name: N,6-dimethyl-N-[(2E)-3-phenylprop-2-en-1-yl]imidazo[1,2-a]pyridine-2-carboxamide
• Synonyms: N,6-dimethyl-N-[(2E)-3-phenylprop-2-en-1-yl]imidazo[1,2-a]pyridine-2-carboxamide

CALCULATED PROPERTIES

JChem

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.282293
• LogD (pH = 7.4): 3.291089
• Log P: 3.2912023
• Molar Refractivity: 94.4086 cm^3
• Polarizability: 34.69135 Å^3
• Polar Surface Area: 37.61 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

供应商提供(Chembridge)

• H Acceptors: 2
• H Donor: 0
• Log P: 2.82
• LOG S: -3.83
• Polar Surface Area: 37.61 Å^2
• Rotatable Bonds: 4