ChemSpider 2D Image | N-(3-Hydroxypropyl)-1-[1-(4-isopropylbenzyl)-3-piperidinyl]-1H-1,2,3-triazole-4-carboxamide | C21H31N5O2

N-(3-Hydroxypropyl)-1-[1-(4-isopropylbenzyl)-3-piperidinyl]-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC21H31N5O2
  • Average mass385.503 Da
  • Monoisotopic mass385.247772 Da
  • ChemSpider ID22222291

More details:

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

1H-1,2,3-Triazole-4-carboxamide, N-(3-hydroxypropyl)-1-[1-[[4-(1-methylethyl)phenyl]methyl]-3-piperidinyl]- [ACD/Index Name]
N-(3-Hydroxypropyl)-1-[1-(4-isopropylbenzyl)-3-piperidinyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
N-(3-Hydroxypropyl)-1-[1-(4-isopropylbenzyl)-3-piperidinyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N-(3-Hydroxypropyl)-1-[1-(4-isopropylbenzyl)-3-pipéridinyl]-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]

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: 1.620
Molar Refractivity: 110.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.31
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.57
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 4.14
ACD/KOC (pH 7.4): 72.19
Polar Surface Area: 83 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 47.9±7.0 dyne/cm
Molar Volume: 313.5±7.0 cm3

Click to predict properties on the Chemicalize site


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