ChemSpider 2D Image | N-Cyclooctyl-4-oxo-1-(2-pyridinylmethyl)-N'-[3-(1-pyrrolidinyl)propyl]-1,4-dihydro-3,5-pyridinedicarboxamide | C28H39N5O3

N-Cyclooctyl-4-oxo-1-(2-pyridinylmethyl)-N'-[3-(1-pyrrolidinyl)propyl]-1,4-dihydro-3,5-pyridinedicarboxamide

  • Molecular FormulaC28H39N5O3
  • Average mass493.641 Da
  • Monoisotopic mass493.305298 Da
  • ChemSpider ID22205504

More details:

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

3,5-Pyridinedicarboxamide, N3-cyclooctyl-1,4-dihydro-4-oxo-1-(2-pyridinylmethyl)-N5-[3-(1-pyrrolidinyl)propyl]- [ACD/Index Name]
N-Cyclooctyl-4-oxo-1-(2-pyridinylmethyl)-N'-[3-(1-pyrrolidinyl)propyl]-1,4-dihydro-3,5-pyridindicarboxamid [German] [ACD/IUPAC Name]
N-Cyclooctyl-4-oxo-1-(2-pyridinylmethyl)-N'-[3-(1-pyrrolidinyl)propyl]-1,4-dihydro-3,5-pyridinedicarboxamide [ACD/IUPAC Name]
N-Cyclooctyl-4-oxo-1-(2-pyridinylméthyl)-N'-[3-(1-pyrrolidinyl)propyl]-1,4-dihydro-3,5-pyridinedicarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 744.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 403.9±32.9 °C
Index of Refraction: 1.603
Molar Refractivity: 139.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): -1.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 58.2±5.0 dyne/cm
Molar Volume: 406.5±5.0 cm3

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