ChemSpider 2D Image | 3-Isobutyl-1-methyl-N-{2-[methyl(methylsulfonyl)amino]ethyl}-1H-pyrazole-5-carboxamide | C13H24N4O3S

3-Isobutyl-1-methyl-N-{2-[methyl(methylsulfonyl)amino]ethyl}-1H-pyrazole-5-carboxamide

  • Molecular FormulaC13H24N4O3S
  • Average mass316.420 Da
  • Monoisotopic mass316.156921 Da
  • ChemSpider ID29445119

More details:

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

1H-Pyrazole-5-carboxamide, 1-methyl-N-[2-[methyl(methylsulfonyl)amino]ethyl]-3-(2-methylpropyl)- [ACD/Index Name]
3-Isobutyl-1-methyl-N-{2-[methyl(methylsulfonyl)amino]ethyl}-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]
3-Isobutyl-1-methyl-N-{2-[methyl(methylsulfonyl)amino]ethyl}-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
3-Isobutyl-1-méthyl-N-{2-[méthyl(méthylsulfonyl)amino]éthyl}-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
1-METHYL-N-[2-(N-METHYLMETHANESULFONAMIDO)ETHYL]-3-(2-METHYLPROPYL)-1H-PYRAZOLE-5-CARBOXAMIDE
2-METHYL-N-[2-(N-METHYLMETHANESULFONAMIDO)ETHYL]-5-(2-METHYLPROPYL)PYRAZOLE-3-CARBOXAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.562
Molar Refractivity: 83.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.40
ACD/LogD (pH 5.5): 0.48
ACD/BCF (pH 5.5): 1.37
ACD/KOC (pH 5.5): 43.56
ACD/LogD (pH 7.4): 0.48
ACD/BCF (pH 7.4): 1.37
ACD/KOC (pH 7.4): 43.56
Polar Surface Area: 93 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 257.7±7.0 cm3

Click to predict properties on the Chemicalize site


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