ChemSpider 2D Image | (3S)-N-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(methylsulfonyl)-3-piperidinecarboxamide | C12H20N4O3S

(3S)-N-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(methylsulfonyl)-3-piperidinecarboxamide

  • Molecular FormulaC12H20N4O3S
  • Average mass300.377 Da
  • Monoisotopic mass300.125610 Da
  • ChemSpider ID69380700

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-N-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(methylsulfonyl)-3-piperidincarboxamid [German] [ACD/IUPAC Name]
(3S)-N-(1,5-Dimethyl-1H-pyrazol-4-yl)-1-(methylsulfonyl)-3-piperidinecarboxamide [ACD/IUPAC Name]
(3S)-N-(1,5-Diméthyl-1H-pyrazol-4-yl)-1-(méthylsulfonyl)-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, N-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(methylsulfonyl)-, (3S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.634
Molar Refractivity: 76.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.08
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.07
ACD/KOC (pH 5.5): 36.53
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.07
ACD/KOC (pH 7.4): 36.60
Polar Surface Area: 93 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 214.8±7.0 cm3

Click to predict properties on the Chemicalize site


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