ChemSpider 2D Image | 2-{4-[1-(Cyclohexylcarbonyl)prolyl]-1-piperazinyl}-N-isopropylacetamide | C21H36N4O3

2-{4-[1-(Cyclohexylcarbonyl)prolyl]-1-piperazinyl}-N-isopropylacetamide

  • Molecular FormulaC21H36N4O3
  • Average mass392.535 Da
  • Monoisotopic mass392.278748 Da
  • ChemSpider ID29644181

More details:

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

1-Piperazineacetamide, 4-[[1-(cyclohexylcarbonyl)-2-pyrrolidinyl]carbonyl]-N-(1-methylethyl)- [ACD/Index Name]
2-{4-[1-(Cyclohexylcarbonyl)prolyl]-1-piperazinyl}-N-isopropylacetamid [German] [ACD/IUPAC Name]
2-{4-[1-(Cyclohexylcarbonyl)prolyl]-1-piperazinyl}-N-isopropylacetamide [ACD/IUPAC Name]
2-{4-[1-(Cyclohexylcarbonyl)prolyl]-1-pipérazinyl}-N-isopropylacétamide [French] [ACD/IUPAC Name]
2-(4-{[1-(cyclohexylcarbonyl)pyrrolidin-2-yl]carbonyl}piperazin-1-yl)-N-isopropylacetamide
2-[4-(1-CYCLOHEXANECARBONYLPYRROLIDINE-2-CARBONYL)PIPERAZIN-1-YL]-N-(PROPAN-2-YL)ACETAMIDE
2-[4-(1-CYCLOHEXANECARBONYLPYRROLIDINE-2-CARBONYL)PIPERAZIN-1-YL]-N-ISOPROPYLACETAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 636.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.7±31.5 °C
Index of Refraction: 1.538
Molar Refractivity: 107.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 9.23
ACD/KOC (pH 5.5): 169.85
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 9.39
ACD/KOC (pH 7.4): 172.96
Polar Surface Area: 73 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 342.8±3.0 cm3

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