ChemSpider 2D Image | 1-(3-Ethyl-1,4-dimethyl-1H-pyrazol-5-yl)-3-{[1-(2-methoxyethyl)-3-pyrrolidinyl]methyl}urea | C16H29N5O2

1-(3-Ethyl-1,4-dimethyl-1H-pyrazol-5-yl)-3-{[1-(2-methoxyethyl)-3-pyrrolidinyl]methyl}urea

  • Molecular FormulaC16H29N5O2
  • Average mass323.434 Da
  • Monoisotopic mass323.232117 Da
  • ChemSpider ID52570681

More details:

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

1-(3-Ethyl-1,4-dimethyl-1H-pyrazol-5-yl)-3-{[1-(2-methoxyethyl)-3-pyrrolidinyl]methyl}harnstoff [German] [ACD/IUPAC Name]
1-(3-Ethyl-1,4-dimethyl-1H-pyrazol-5-yl)-3-{[1-(2-methoxyethyl)-3-pyrrolidinyl]methyl}urea [ACD/IUPAC Name]
1-(3-Éthyl-1,4-diméthyl-1H-pyrazol-5-yl)-3-{[1-(2-méthoxyéthyl)-3-pyrrolidinyl]méthyl}urée [French] [ACD/IUPAC Name]
Urea, N-(3-ethyl-1,4-dimethyl-1H-pyrazol-5-yl)-N'-[[1-(2-methoxyethyl)-3-pyrrolidinyl]methyl]- [ACD/Index Name]
N-(3-ethyl-1,4-dimethyl-1H-pyrazol-5-yl)-N'-{[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl}urea

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

Density: 1.2±0.1 g/cm3
Boiling Point: 439.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 219.4±28.7 °C
Index of Refraction: 1.581
Molar Refractivity: 89.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.36
ACD/LogD (pH 5.5): -1.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.70
Polar Surface Area: 71 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 41.9±7.0 dyne/cm
Molar Volume: 269.2±7.0 cm3

Click to predict properties on the Chemicalize site


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