ChemSpider 2D Image | 2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-N-{1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinyl}acetamide | C18H22FN5O2

2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-N-{1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinyl}acetamide

  • Molecular FormulaC18H22FN5O2
  • Average mass359.398 Da
  • Monoisotopic mass359.175751 Da
  • ChemSpider ID22195463

More details:

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

1H-Pyrazole-1-acetamide, 5-amino-N-[1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinyl]-3-methyl- [ACD/Index Name]
2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-N-{1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinyl}acetamide [ACD/IUPAC Name]
2-(5-Amino-3-méthyl-1H-pyrazol-1-yl)-N-{1-[2-(4-fluorophényl)éthyl]-5-oxo-3-pyrrolidinyl}acétamide [French] [ACD/IUPAC Name]
2-(5-Amino-3-methyl-1H-pyrazol-1-yl)-N-{1-[2-(4-fluorphenyl)ethyl]-5-oxo-3-pyrrolidinyl}acetamid [German] [ACD/IUPAC Name]
2-(5-AMINO-3-METHYL-1H-PYRAZOL-1-YL)-N-{1-[2-(4-FLUOROPHENYL)ETHYL]-5-OXOPYRROLIDIN-3-YL}ACETAMIDE
2-(5-AMINO-3-METHYLPYRAZOL-1-YL)-N-{1-[2-(4-FLUOROPHENYL)ETHYL]-5-OXOPYRROLIDIN-3-YL}ACETAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 671.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 359.6±31.5 °C
Index of Refraction: 1.649
Molar Refractivity: 95.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.03
ACD/KOC (pH 5.5): 76.38
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 3.11
ACD/KOC (pH 7.4): 78.30
Polar Surface Area: 93 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 261.1±7.0 cm3

Click to predict properties on the Chemicalize site


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