Found 1 result

Search term: XHHXGKRFUPEPFM-OAHLLOKOSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-Ethyl-4-methyl-N-{4-[(2S)-2-morpholinyl]phenyl}-1H-pyrazole-3-carboxamide | C17H22N4O2

5-Ethyl-4-methyl-N-{4-[(2S)-2-morpholinyl]phenyl}-1H-pyrazole-3-carboxamide

  • Molecular FormulaC17H22N4O2
  • Average mass314.382 Da
  • Monoisotopic mass314.174286 Da
  • ChemSpider ID81368309

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Pyrazole-3-carboxamide, 5-ethyl-4-methyl-N-[4-[(2S)-2-morpholinyl]phenyl]- [ACD/Index Name]
2133417-13-5 [RN]
5-Ethyl-4-methyl-N-{4-[(2S)-2-morpholinyl]phenyl}-1H-pyrazol-3-carboxamid [German] [ACD/IUPAC Name]
5-Ethyl-4-methyl-N-{4-[(2S)-2-morpholinyl]phenyl}-1H-pyrazole-3-carboxamide [ACD/IUPAC Name]
5-Éthyl-4-méthyl-N-{4-[(2S)-2-morpholinyl]phényl}-1H-pyrazole-3-carboxamide [French] [ACD/IUPAC Name]
5-ethyl-4-methyl-N-{4-[(2S)-morpholin-2-yl]phenyl}-1H-pyrazole-3-carboxamide
5-ethyl-4-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1H-pyrazole-3-carboxamide
Ralmitaront

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

Density: 1.2±0.1 g/cm3
Boiling Point: 490.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 250.1±28.7 °C
Index of Refraction: 1.611
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): -1.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.78
Polar Surface Area: 79 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 257.2±3.0 cm3

Click to predict properties on the Chemicalize site


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