ChemSpider 2D Image | 3-(2-Ethyl-1H-imidazol-1-yl)-1-{3-[(4-isopropylphenyl)amino]-1-piperidinyl}-1-propanone | C22H32N4O

3-(2-Ethyl-1H-imidazol-1-yl)-1-{3-[(4-isopropylphenyl)amino]-1-piperidinyl}-1-propanone

  • Molecular FormulaC22H32N4O
  • Average mass368.516 Da
  • Monoisotopic mass368.257599 Da
  • ChemSpider ID22237686

More details:

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

1-Propanone, 3-(2-ethyl-1H-imidazol-1-yl)-1-[3-[[4-(1-methylethyl)phenyl]amino]-1-piperidinyl]- [ACD/Index Name]
3-(2-Ethyl-1H-imidazol-1-yl)-1-{3-[(4-isopropylphenyl)amino]-1-piperidinyl}-1-propanon [German] [ACD/IUPAC Name]
3-(2-Ethyl-1H-imidazol-1-yl)-1-{3-[(4-isopropylphenyl)amino]-1-piperidinyl}-1-propanone [ACD/IUPAC Name]
3-(2-Éthyl-1H-imidazol-1-yl)-1-{3-[(4-isopropylphényl)amino]-1-pipéridinyl}-1-propanone [French] [ACD/IUPAC Name]
1-[3-(2-ethyl-1H-imidazol-1-yl)propanoyl]-N-(4-isopropylphenyl)-3-piperidinamine
3-(2-ETHYL-1H-IMIDAZOL-1-YL)-1-(3-{[4-(PROPAN-2-YL)PHENYL]AMINO}PIPERIDIN-1-YL)PROPAN-1-ONE
3-(2-ETHYLIMIDAZOL-1-YL)-1-{3-[(4-ISOPROPYLPHENYL)AMINO]PIPERIDIN-1-YL}PROPAN-1-ONE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 587.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 309.0±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 110.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 1.54
ACD/KOC (pH 5.5): 11.96
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 76.27
ACD/KOC (pH 7.4): 592.60
Polar Surface Area: 50 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 41.7±7.0 dyne/cm
Molar Volume: 326.8±7.0 cm3

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