ChemSpider 2D Image | 1-[2-(3-Fluorophenyl)ethyl]-5-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}-2-piperidinone | C21H29FN2O3

1-[2-(3-Fluorophenyl)ethyl]-5-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}-2-piperidinone

  • Molecular FormulaC21H29FN2O3
  • Average mass376.465 Da
  • Monoisotopic mass376.216217 Da
  • ChemSpider ID23068893

More details:

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

1-[2-(3-Fluorophenyl)ethyl]-5-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}-2-piperidinone [ACD/IUPAC Name]
1-[2-(3-Fluorophényl)éthyl]-5-{[4-(méthoxyméthyl)-1-pipéridinyl]carbonyl}-2-pipéridinone [French] [ACD/IUPAC Name]
1-[2-(3-Fluorphenyl)ethyl]-5-{[4-(methoxymethyl)-1-piperidinyl]carbonyl}-2-piperidinon [German] [ACD/IUPAC Name]
2-Piperidinone, 1-[2-(3-fluorophenyl)ethyl]-5-[[4-(methoxymethyl)-1-piperidinyl]carbonyl]- [ACD/Index Name]
1-[2-(3-FLUOROPHENYL)ETHYL]-5-[4-(METHOXYMETHYL)PIPERIDINE-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: 557.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 290.6±30.1 °C
Index of Refraction: 1.532
Molar Refractivity: 100.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.05
ACD/LogD (pH 5.5): 2.39
ACD/BCF (pH 5.5): 38.32
ACD/KOC (pH 5.5): 473.20
ACD/LogD (pH 7.4): 2.39
ACD/BCF (pH 7.4): 38.32
ACD/KOC (pH 7.4): 473.20
Polar Surface Area: 50 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 325.2±3.0 cm3

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