Found 1 result

Search term: CIGIIVQVOWUOHH-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-Ethyl-N-({3-[1-(4-methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-2-(1H-pyrazol-1-yl)ethanamine | C22H29N5O

N-Ethyl-N-({3-[1-(4-methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-2-(1H-pyrazol-1-yl)ethanamine

  • Molecular FormulaC22H29N5O
  • Average mass379.499 Da
  • Monoisotopic mass379.237213 Da
  • ChemSpider ID23071749

More details:

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

1,2,4-Oxadiazole-5-methanamine, N-ethyl-3-[1-(4-methylphenyl)cyclopentyl]-N-[2-(1H-pyrazol-1-yl)ethyl]- [ACD/Index Name]
N-Ethyl-N-({3-[1-(4-methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-2-(1H-pyrazol-1-yl)ethanamin [German] [ACD/IUPAC Name]
N-Ethyl-N-({3-[1-(4-methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-2-(1H-pyrazol-1-yl)ethanamine [ACD/IUPAC Name]
N-Éthyl-N-({3-[1-(4-méthylphényl)cyclopentyl]-1,2,4-oxadiazol-5-yl}méthyl)-2-(1H-pyrazol-1-yl)éthanamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 541.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 281.0±32.9 °C
Index of Refraction: 1.624
Molar Refractivity: 112.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 383.02
ACD/KOC (pH 5.5): 2009.22
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 769.10
ACD/KOC (pH 7.4): 4034.51
Polar Surface Area: 60 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 318.4±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement