ChemSpider 2D Image | 1-(2-{3-[(4-Fluorophenyl)amino]-1-piperidinyl}-2-oxoethyl)-2-piperidinone | C18H24FN3O2

1-(2-{3-[(4-Fluorophenyl)amino]-1-piperidinyl}-2-oxoethyl)-2-piperidinone

  • Molecular FormulaC18H24FN3O2
  • Average mass333.401 Da
  • Monoisotopic mass333.185242 Da
  • ChemSpider ID22152102

More details:

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

1-(2-{3-[(4-Fluorophenyl)amino]-1-piperidinyl}-2-oxoethyl)-2-piperidinone [ACD/IUPAC Name]
1-(2-{3-[(4-Fluorophényl)amino]-1-pipéridinyl}-2-oxoéthyl)-2-pipéridinone [French] [ACD/IUPAC Name]
1-(2-{3-[(4-Fluorphenyl)amino]-1-piperidinyl}-2-oxoethyl)-2-piperidinon [German] [ACD/IUPAC Name]
2-Piperidinone, 1-[2-[3-[(4-fluorophenyl)amino]-1-piperidinyl]-2-oxoethyl]- [ACD/Index Name]
1-(2-{3-[(4-FLUOROPHENYL)AMINO]PIPERIDIN-1-YL}-2-OXOETHYL)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: 565.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.6±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 89.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 10.98
ACD/KOC (pH 5.5): 185.73
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.65
ACD/KOC (pH 7.4): 213.93
Polar Surface Area: 53 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 268.0±3.0 cm3

Click to predict properties on the Chemicalize site


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