ChemSpider 2D Image | 1-[2-(3-Fluorophenyl)ethyl]-5-[(4-isopropyl-1-piperazinyl)carbonyl]-2-piperidinone | C21H30FN3O2

1-[2-(3-Fluorophenyl)ethyl]-5-[(4-isopropyl-1-piperazinyl)carbonyl]-2-piperidinone

  • Molecular FormulaC21H30FN3O2
  • Average mass375.480 Da
  • Monoisotopic mass375.232208 Da
  • ChemSpider ID23058907

More details:

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

1-[2-(3-Fluorophenyl)ethyl]-5-[(4-isopropyl-1-piperazinyl)carbonyl]-2-piperidinone [ACD/IUPAC Name]
1-[2-(3-Fluorophényl)éthyl]-5-[(4-isopropyl-1-pipérazinyl)carbonyl]-2-pipéridinone [French] [ACD/IUPAC Name]
1-[2-(3-Fluorphenyl)ethyl]-5-[(4-isopropyl-1-piperazinyl)carbonyl]-2-piperidinon [German] [ACD/IUPAC Name]
2-Piperidinone, 1-[2-(3-fluorophenyl)ethyl]-5-[[4-(1-methylethyl)-1-piperazinyl]carbonyl]- [ACD/Index Name]
1-[2-(3-FLUOROPHENYL)ETHYL]-5-(4-ISOPROPYLPIPERAZINE-1-CARBONYL)PIPERIDIN-2-ONE
1-[2-(3-FLUOROPHENYL)ETHYL]-5-[4-(PROPAN-2-YL)PIPERAZINE-1-CARBONYL]PIPERIDIN-2-ONE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 552.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 287.8±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 102.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.27
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 15.73
ACD/KOC (pH 7.4): 225.56
Polar Surface Area: 44 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 324.5±3.0 cm3

Click to predict properties on the Chemicalize site


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