ChemSpider 2D Image | N-[4-(Dimethylamino)benzyl]-1-[6-(4-ethylphenoxy)-4-pyrimidinyl]-4-piperidinecarboxamide | C27H33N5O2

N-[4-(Dimethylamino)benzyl]-1-[6-(4-ethylphenoxy)-4-pyrimidinyl]-4-piperidinecarboxamide

  • Molecular FormulaC27H33N5O2
  • Average mass459.583 Da
  • Monoisotopic mass459.263428 Da
  • ChemSpider ID26317279

More details:

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

4-Piperidinecarboxamide, N-[[4-(dimethylamino)phenyl]methyl]-1-[6-(4-ethylphenoxy)-4-pyrimidinyl]- [ACD/Index Name]
N-[4-(Dimethylamino)benzyl]-1-[6-(4-ethylphenoxy)-4-pyrimidinyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-[4-(Dimethylamino)benzyl]-1-[6-(4-ethylphenoxy)-4-pyrimidinyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-[4-(Diméthylamino)benzyl]-1-[6-(4-éthylphénoxy)-4-pyrimidinyl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1-[6-(4-Ethyl-phenoxy)-pyrimidin-4-yl]-piperidine-4-carboxylic acid 4-dimethylamino-benzylamide
1115999-18-2 [RN]
N-(4-(dimethylamino)benzyl)-1-(6-(4-ethylphenoxy)pyrimidin-4-yl)piperidine-4-carboxamide
N-[4-(dimethylamino)benzyl]-1-[6-(4-ethylphenoxy)pyrimidin-4-yl]piperidine-4-carboxamide
N-{[4-(DIMETHYLAMINO)PHENYL]METHYL}-1-[6-(4-ETHYLPHENOXY)PYRIMIDIN-4-YL]PIPERIDINE-4-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: 698.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 376.1±31.5 °C
Index of Refraction: 1.607
Molar Refractivity: 134.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.03
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 511.39
ACD/KOC (pH 5.5): 1911.36
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2460.70
ACD/KOC (pH 7.4): 9197.17
Polar Surface Area: 71 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 390.3±3.0 cm3

Click to predict properties on the Chemicalize site


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