ChemSpider 2D Image | (3S,5R)-N-Cyclohexyl-N'-(2,3-dihydro-1H-inden-5-yl)-1-isobutyl-3,5-piperidinedicarboxamide | C26H39N3O2

(3S,5R)-N-Cyclohexyl-N'-(2,3-dihydro-1H-inden-5-yl)-1-isobutyl-3,5-piperidinedicarboxamide

  • Molecular FormulaC26H39N3O2
  • Average mass425.607 Da
  • Monoisotopic mass425.304230 Da
  • ChemSpider ID29656272

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,5R)-N-Cyclohexyl-N'-(2,3-dihydro-1H-inden-5-yl)-1-isobutyl-3,5-piperidindicarboxamid [German] [ACD/IUPAC Name]
(3S,5R)-N-Cyclohexyl-N'-(2,3-dihydro-1H-inden-5-yl)-1-isobutyl-3,5-piperidinedicarboxamide [ACD/IUPAC Name]
(3S,5R)-N-Cyclohexyl-N'-(2,3-dihydro-1H-indén-5-yl)-1-isobutyl-3,5-pipéridinedicarboxamide [French] [ACD/IUPAC Name]
3,5-Piperidinedicarboxamide, N3-cyclohexyl-N5-(2,3-dihydro-1H-inden-5-yl)-1-(2-methylpropyl)-, (3S,5R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 650.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 347.4±31.5 °C
Index of Refraction: 1.575
Molar Refractivity: 124.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 5.72
ACD/KOC (pH 5.5): 27.39
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 286.15
ACD/KOC (pH 7.4): 1369.69
Polar Surface Area: 61 Å2
Polarizability: 49.4±0.5 10-24cm3
Surface Tension: 49.2±5.0 dyne/cm
Molar Volume: 376.8±5.0 cm3

Click to predict properties on the Chemicalize site


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