ChemSpider 2D Image | 4-{3-[(5-Ethynyl-2-pyridinyl)oxy]benzyl}-N-(3-pyridinyl)-1-piperidinecarboxamide | C25H24N4O2

4-{3-[(5-Ethynyl-2-pyridinyl)oxy]benzyl}-N-(3-pyridinyl)-1-piperidinecarboxamide

  • Molecular FormulaC25H24N4O2
  • Average mass412.484 Da
  • Monoisotopic mass412.189911 Da
  • ChemSpider ID26519072

More details:

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

1196109-53-1 [RN]
1-Piperidinecarboxamide, 4-[[3-[(5-ethynyl-2-pyridinyl)oxy]phenyl]methyl]-N-3-pyridinyl- [ACD/Index Name]
4-[[3-[(5-ETHYNYL-2-PYRIDINYL)OXY]PHENYL]METHYL]-N-3-PYRIDINYL-1-PIPERIDINECARBOXAMIDE
4-{3-[(5-Ethinyl-2-pyridinyl)oxy]benzyl}-N-(3-pyridinyl)-1-piperidincarboxamid [German] [ACD/IUPAC Name]
4-{3-[(5-Ethynyl-2-pyridinyl)oxy]benzyl}-N-(3-pyridinyl)-1-piperidinecarboxamide [ACD/IUPAC Name]
4-{3-[(5-Éthynyl-2-pyridinyl)oxy]benzyl}-N-(3-pyridinyl)-1-pipéridinecarboxamide [French] [ACD/IUPAC Name]
[1196109-53-1] [RN]
4-((3-((5-ethynyl-2-pyridinyl)oxy)phenyl)methyl)-n-3-pyridinyl-1-piperidinecarboxamide
4-({3-[(5-ethynylpyridin-2-yl)oxy]phenyl}methyl)-N-(pyridin-3-yl)piperidine-1-carboxamide
4-(3-((5-Ethynylpyridin-2-yl)oxy)benzyl)-N-(pyridin-3-yl)piperidine-1-carboxamide
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point: 641.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.0±31.5 °C
Index of Refraction: 1.651
Molar Refractivity: 118.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 112.91
ACD/KOC (pH 5.5): 867.16
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 201.71
ACD/KOC (pH 7.4): 1549.14
Polar Surface Area: 67 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 66.6±5.0 dyne/cm
Molar Volume: 324.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement