ChemSpider 2D Image | N-{2-[(Dimethylcarbamoyl)amino]ethyl}-1-(3-methyl-4-nitrobenzoyl)prolinamide | C18H25N5O5

N-{2-[(Dimethylcarbamoyl)amino]ethyl}-1-(3-methyl-4-nitrobenzoyl)prolinamide

  • Molecular FormulaC18H25N5O5
  • Average mass391.422 Da
  • Monoisotopic mass391.185577 Da
  • ChemSpider ID30408710

More details:

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

2-Pyrrolidinecarboxamide, N-[2-[[(dimethylamino)carbonyl]amino]ethyl]-1-(3-methyl-4-nitrobenzoyl)- [ACD/Index Name]
N-{2-[(Dimethylcarbamoyl)amino]ethyl}-1-(3-methyl-4-nitrobenzoyl)prolinamid [German] [ACD/IUPAC Name]
N-{2-[(Dimethylcarbamoyl)amino]ethyl}-1-(3-methyl-4-nitrobenzoyl)prolinamide [ACD/IUPAC Name]
N-{2-[(Diméthylcarbamoyl)amino]éthyl}-1-(3-méthyl-4-nitrobenzoyl)prolinamide [French] [ACD/IUPAC Name]
N-{2-[(DIMETHYLCARBAMOYL)AMINO]ETHYL}-1-(3-METHYL-4-NITROBENZOYL)PYRROLIDINE-2-CARBOXAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 742.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.3±3.0 kJ/mol
Flash Point: 402.9±32.9 °C
Index of Refraction: 1.583
Molar Refractivity: 101.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.51
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.65
ACD/KOC (pH 5.5): 49.87
ACD/LogD (pH 7.4): 0.59
ACD/BCF (pH 7.4): 1.65
ACD/KOC (pH 7.4): 49.87
Polar Surface Area: 128 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 304.2±3.0 cm3

Click to predict properties on the Chemicalize site


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