ChemSpider 2D Image | 5-Amino-2-methyl-N-[(1R)-1-(1-naphthyl)ethyl]benzamide | C20H20N2O

5-Amino-2-methyl-N-[(1R)-1-(1-naphthyl)ethyl]benzamide

  • Molecular FormulaC20H20N2O
  • Average mass304.386 Da
  • Monoisotopic mass304.157562 Da
  • ChemSpider ID24617535

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1093070-16-6 [RN]
5-Amino-2-methyl-N-[(1R)-1-(1-naphthyl)ethyl]benzamid [German] [ACD/IUPAC Name]
5-Amino-2-methyl-N-[(1R)-1-(1-naphthyl)ethyl]benzamide [ACD/IUPAC Name]
5-Amino-2-méthyl-N-[(1R)-1-(1-naphtyl)éthyl]benzamide [French] [ACD/IUPAC Name]
5-amino-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide
5-amino-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
Benzamide, 5-amino-2-methyl-N-[(1R)-1-(1-naphthalenyl)ethyl]- [ACD/Index Name]
5-amino-2-methyl-n-(1r-naphthalen-1-ylethyl)benzamide
5-Amino-2-methyl-N-(1R-naphthalen-1-yl-ethyl)-benzamide
5-amino-2-methyl-N-[(1R)-1-(1-naphthalenyl)ethyl]-benzamide
More...
  • Miscellaneous

    • Chemical Class:

      A benzamide resulting from the formal condensation of the carboxy group of 5-amino-2-methylbenzoic acid with the amino group of (1R)-1-(naphthalen-1-yl)ethan-1-amine. It is a potent noncovalent inhibi tor (IC50 = 600 nM) of severe acute respiratory syndrome-coronavirus papain-like protease (SARS-CoV PLpro). ChEBI CHEBI:167176

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 514.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.2±30.1 °C
Index of Refraction: 1.658
Molar Refractivity: 95.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 422.69
ACD/KOC (pH 5.5): 2613.41
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 436.78
ACD/KOC (pH 7.4): 2700.56
Polar Surface Area: 55 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 260.4±3.0 cm3

Click to predict properties on the Chemicalize site


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