ChemSpider 2D Image | N-(3-Chlorobenzyl)-1-(4-methylpentanoyl)-L-prolinamide | C18H25ClN2O2

N-(3-Chlorobenzyl)-1-(4-methylpentanoyl)-L-prolinamide

  • Molecular FormulaC18H25ClN2O2
  • Average mass336.856 Da
  • Monoisotopic mass336.160461 Da
  • ChemSpider ID25057569
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

2-Pyrrolidinecarboxamide, N-[(3-chlorophenyl)methyl]-1-(4-methyl-1-oxopentyl)-, (2S)- [ACD/Index Name]
N-(3-Chlorbenzyl)-1-(4-methylpentanoyl)-L-prolinamid [German] [ACD/IUPAC Name]
N-(3-Chlorobenzyl)-1-(4-methylpentanoyl)-L-prolinamide [ACD/IUPAC Name]
N-(3-Chlorobenzyl)-1-(4-méthylpentanoyl)-L-prolinamide [French] [ACD/IUPAC Name]
(2S)-N-[(3-chlorophenyl)methyl]-1-(4-methylpentanoyl)pyrrolidine-2-carboxamide
16U

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 556.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.1±30.1 °C
Index of Refraction: 1.546
Molar Refractivity: 91.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 133.53
ACD/KOC (pH 5.5): 1156.40
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 133.53
ACD/KOC (pH 7.4): 1156.40
Polar Surface Area: 49 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 290.2±3.0 cm3

Click to predict properties on the Chemicalize site






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