ChemSpider 2D Image | 1-[2-(3-Fluorophenyl)ethyl]-N-methyl-N-(1-methyl-4-piperidinyl)-6-oxo-3-piperidinecarboxamide | C21H30FN3O2

1-[2-(3-Fluorophenyl)ethyl]-N-methyl-N-(1-methyl-4-piperidinyl)-6-oxo-3-piperidinecarboxamide

  • Molecular FormulaC21H30FN3O2
  • Average mass375.480 Da
  • Monoisotopic mass375.232208 Da
  • ChemSpider ID22212111

More details:

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

1-[2-(3-Fluorophenyl)ethyl]-N-methyl-N-(1-methyl-4-piperidinyl)-6-oxo-3-piperidinecarboxamide [ACD/IUPAC Name]
1-[2-(3-Fluorophényl)éthyl]-N-méthyl-N-(1-méthyl-4-pipéridinyl)-6-oxo-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1-[2-(3-Fluorphenyl)ethyl]-N-methyl-N-(1-methyl-4-piperidinyl)-6-oxo-3-piperidincarboxamid [German] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-[2-(3-fluorophenyl)ethyl]-N-methyl-N-(1-methyl-4-piperidinyl)-6-oxo- [ACD/Index Name]
1-[2-(3-FLUOROPHENYL)ETHYL]-N-METHYL-N-(1-METHYLPIPERIDIN-4-YL)-6-OXOPIPERIDINE-3-CARBOXAMIDE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 546.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.6±3.0 kJ/mol
Flash Point: 284.4±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 104.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.71
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 1.97
ACD/KOC (pH 7.4): 30.94
Polar Surface Area: 44 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 49.1±5.0 dyne/cm
Molar Volume: 316.7±5.0 cm3

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