ChemSpider 2D Image | 2-Methyl-N-[(8-{4-[methyl(phenyl)amino]benzyl}-1-oxa-8-azaspiro[4.5]dec-2-yl)methyl]propanamide | C27H37N3O2

2-Methyl-N-[(8-{4-[methyl(phenyl)amino]benzyl}-1-oxa-8-azaspiro[4.5]dec-2-yl)methyl]propanamide

  • Molecular FormulaC27H37N3O2
  • Average mass435.602 Da
  • Monoisotopic mass435.288574 Da
  • ChemSpider ID22156868

More details:

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

2-Methyl-N-[(8-{4-[methyl(phenyl)amino]benzyl}-1-oxa-8-azaspiro[4.5]dec-2-yl)methyl]propanamid [German] [ACD/IUPAC Name]
2-Methyl-N-[(8-{4-[methyl(phenyl)amino]benzyl}-1-oxa-8-azaspiro[4.5]dec-2-yl)methyl]propanamide [ACD/IUPAC Name]
2-Méthyl-N-[(8-{4-[méthyl(phényl)amino]benzyl}-1-oxa-8-azaspiro[4.5]déc-2-yl)méthyl]propanamide [French] [ACD/IUPAC Name]
Propanamide, 2-methyl-N-[[8-[[4-(methylphenylamino)phenyl]methyl]-1-oxa-8-azaspiro[4.5]dec-2-yl]methyl]- [ACD/Index Name]
2-METHYL-N-{[8-({4-[METHYL(PHENYL)AMINO]PHENYL}METHYL)-1-OXA-8-AZASPIRO[4.5]DECAN-2-YL]METHYL}PROPANAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 624.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 331.4±31.5 °C
Index of Refraction: 1.598
Molar Refractivity: 130.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.25
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 6.04
ACD/KOC (pH 5.5): 19.63
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 207.66
ACD/KOC (pH 7.4): 674.65
Polar Surface Area: 45 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 50.5±5.0 dyne/cm
Molar Volume: 381.2±5.0 cm3

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