ChemSpider 2D Image | N-{3-[Butyl(hexyl)amino]-1-(2-methyl-2-propanyl)-1H-1,2,4-triazol-5-yl}-1-(2-methyl-2-propanyl)-5-oxo-3-pyrrolidinecarboxamide | C25H46N6O2

N-{3-[Butyl(hexyl)amino]-1-(2-methyl-2-propanyl)-1H-1,2,4-triazol-5-yl}-1-(2-methyl-2-propanyl)-5-oxo-3-pyrrolidinecarboxamide

  • Molecular FormulaC25H46N6O2
  • Average mass462.672 Da
  • Monoisotopic mass462.368225 Da
  • ChemSpider ID123254857

More details:

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

3-Pyrrolidinecarboxamide, N-[3-(butylhexylamino)-1-(1,1-dimethylethyl)-1H-1,2,4-triazol-5-yl]-1-(1,1-dimethylethyl)-5-oxo- [ACD/Index Name]
N-{3-[Butyl(hexyl)amino]-1-(2-methyl-2-propanyl)-1H-1,2,4-triazol-5-yl}-1-(2-methyl-2-propanyl)-5-oxo-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
N-{3-[Butyl(hexyl)amino]-1-(2-methyl-2-propanyl)-1H-1,2,4-triazol-5-yl}-1-(2-methyl-2-propanyl)-5-oxo-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
N-{3-[Butyl(hexyl)amino]-1-(2-méthyl-2-propanyl)-1H-1,2,4-triazol-5-yl}-1-(2-méthyl-2-propanyl)-5-oxo-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.552
Molar Refractivity: 135.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 2301.79
ACD/KOC (pH 5.5): 7594.60
ACD/LogD (pH 7.4): 5.04
ACD/BCF (pH 7.4): 3945.72
ACD/KOC (pH 7.4): 13018.66
Polar Surface Area: 83 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 38.5±7.0 dyne/cm
Molar Volume: 422.5±7.0 cm3

Click to predict properties on the Chemicalize site


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