ChemSpider 2D Image | N-(5-Bromo-2-pyridinyl)-1-{2-[ethyl(3-fluorobenzyl)amino]-2-oxoethyl}-3-piperidinecarboxamide | C22H26BrFN4O2

N-(5-Bromo-2-pyridinyl)-1-{2-[ethyl(3-fluorobenzyl)amino]-2-oxoethyl}-3-piperidinecarboxamide

  • Molecular FormulaC22H26BrFN4O2
  • Average mass477.370 Da
  • Monoisotopic mass476.122314 Da
  • ChemSpider ID33496799

More details:

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

1-Piperidineacetamide, 3-[[(5-bromo-2-pyridinyl)amino]carbonyl]-N-ethyl-N-[(3-fluorophenyl)methyl]- [ACD/Index Name]
N-(5-Brom-2-pyridinyl)-1-{2-[ethyl(3-fluorbenzyl)amino]-2-oxoethyl}-3-piperidincarboxamid [German] [ACD/IUPAC Name]
N-(5-Bromo-2-pyridinyl)-1-{2-[ethyl(3-fluorobenzyl)amino]-2-oxoethyl}-3-piperidinecarboxamide [ACD/IUPAC Name]
N-(5-Bromo-2-pyridinyl)-1-{2-[éthyl(3-fluorobenzyl)amino]-2-oxoéthyl}-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 634.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 337.6±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 117.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 2.40
ACD/BCF (pH 5.5): 24.18
ACD/KOC (pH 5.5): 192.94
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 164.83
ACD/KOC (pH 7.4): 1315.21
Polar Surface Area: 66 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 341.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement