ChemSpider 2D Image | N~2~-[(1-Isopropyl-1H-1,2,3-triazol-4-yl)carbamoyl]-L-isoleucinamide | C12H22N6O2

N2-[(1-Isopropyl-1H-1,2,3-triazol-4-yl)carbamoyl]-L-isoleucinamide

  • Molecular FormulaC12H22N6O2
  • Average mass282.342 Da
  • Monoisotopic mass282.180420 Da
  • ChemSpider ID30946615

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

N2-[(1-Isopropyl-1H-1,2,3-triazol-4-yl)carbamoyl]-L-isoleucinamid [German] [ACD/IUPAC Name]
N2-[(1-Isopropyl-1H-1,2,3-triazol-4-yl)carbamoyl]-L-isoleucinamide [ACD/IUPAC Name]
N2-[(1-Isopropyl-1H-1,2,3-triazol-4-yl)carbamoyl]-L-isoleucinamide [French] [ACD/IUPAC Name]
Pentanamide, 3-methyl-2-[[[[1-(1-methylethyl)-1H-1,2,3-triazol-4-yl]amino]carbonyl]amino]-, (2S,3S)- [ACD/Index Name]
N2-{[(1-isopropyl-1H-1,2,3-triazol-4-yl)amino]carbonyl}-L-isoleucinamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 74.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.17
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.79
ACD/LogD (pH 7.4): 0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.79
Polar Surface Area: 115 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 214.8±7.0 cm3

Click to predict properties on the Chemicalize site


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