ChemSpider 2D Image | 1-[6-(4-Ethylphenoxy)-4-pyrimidinyl]-N-(3-isopropoxypropyl)-4-piperidinecarboxamide | C24H34N4O3

1-[6-(4-Ethylphenoxy)-4-pyrimidinyl]-N-(3-isopropoxypropyl)-4-piperidinecarboxamide

  • Molecular FormulaC24H34N4O3
  • Average mass426.552 Da
  • Monoisotopic mass426.263092 Da
  • ChemSpider ID27316012

More details:

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

1-[6-(4-Ethylphenoxy)-4-pyrimidinyl]-N-(3-isopropoxypropyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-[6-(4-Ethylphenoxy)-4-pyrimidinyl]-N-(3-isopropoxypropyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
1-[6-(4-Éthylphénoxy)-4-pyrimidinyl]-N-(3-isopropoxypropyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-[6-(4-ethylphenoxy)-4-pyrimidinyl]-N-[3-(1-methylethoxy)propyl]- [ACD/Index Name]
1-[6-(4-ethylphenoxy)pyrimidin-4-yl]-N-(3-isopropoxypropyl)piperidine-4-carboxamide
1-[6-(4-ethylphenoxy)pyrimidin-4-yl]-N-[3-(propan-2-yloxy)propyl]piperidine-4-carboxamide
1-[6-(4-Ethyl-phenoxy)-pyrimidin-4-yl]-piperidine-4-carboxylic acid (3-isopropoxy-propyl)-amide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 629.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 334.4±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 120.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 117.24
ACD/KOC (pH 5.5): 699.80
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 475.09
ACD/KOC (pH 7.4): 2835.90
Polar Surface Area: 77 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 380.9±3.0 cm3

Click to predict properties on the Chemicalize site


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