ChemSpider 2D Image | 3-[(Dimethylamino)methyl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(hydroxymethyl)-1-piperidinecarboxamide | C16H29N5O2

3-[(Dimethylamino)methyl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(hydroxymethyl)-1-piperidinecarboxamide

  • Molecular FormulaC16H29N5O2
  • Average mass323.434 Da
  • Monoisotopic mass323.232117 Da
  • ChemSpider ID57636243

More details:

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

1-Piperidinecarboxamide, 3-[(dimethylamino)methyl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(hydroxymethyl)- [ACD/Index Name]
3-[(Dimethylamino)methyl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(hydroxymethyl)-1-piperidincarboxamid [German] [ACD/IUPAC Name]
3-[(Dimethylamino)methyl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(hydroxymethyl)-1-piperidinecarboxamide [ACD/IUPAC Name]
3-[(Diméthylamino)méthyl]-N-[(1-éthyl-1H-pyrazol-4-yl)méthyl]-3-(hydroxyméthyl)-1-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-[(dimethylamino)methyl]-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(hydroxymethyl)piperidine-1-carboxamide
3-[(DIMETHYLAMINO)METHYL]-N-[(1-ETHYLPYRAZOL-4-YL)METHYL]-3-(HYDROXYMETHYL)PIPERIDINE-1-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: 547.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 284.7±24.6 °C
Index of Refraction: 1.582
Molar Refractivity: 90.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.57
ACD/LogD (pH 5.5): -2.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 74 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 272.3±7.0 cm3

Click to predict properties on the Chemicalize site


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