ChemSpider 2D Image | N-[2-(1-Cyclohexen-1-yl)ethyl]-6-[4-(1-pyrrolidinyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide | C27H39N3O

N-[2-(1-Cyclohexen-1-yl)ethyl]-6-[4-(1-pyrrolidinyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide

  • Molecular FormulaC27H39N3O
  • Average mass421.618 Da
  • Monoisotopic mass421.309326 Da
  • ChemSpider ID22123608

More details:

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

6-Azaspiro[2.5]octane-1-carboxamide, N-[2-(1-cyclohexen-1-yl)ethyl]-6-[[4-(1-pyrrolidinyl)phenyl]methyl]- [ACD/Index Name]
N-[2-(1-Cyclohexen-1-yl)ethyl]-6-[4-(1-pyrrolidinyl)benzyl]-6-azaspiro[2.5]octan-1-carboxamid [German] [ACD/IUPAC Name]
N-[2-(1-Cyclohexen-1-yl)ethyl]-6-[4-(1-pyrrolidinyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [ACD/IUPAC Name]
N-[2-(1-Cyclohexén-1-yl)éthyl]-6-[4-(1-pyrrolidinyl)benzyl]-6-azaspiro[2.5]octane-1-carboxamide [French] [ACD/IUPAC 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: 626.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.6±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 127.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.35
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 5.86
ACD/KOC (pH 7.4): 29.27
Polar Surface Area: 36 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 52.1±5.0 dyne/cm
Molar Volume: 368.3±5.0 cm3

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