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Search term: DVDYCLRLKJHNDC-BNWMHBKRSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-[(3s,5s,7s)-Adamantan-1-yl]-N-[4-(diethylamino)benzyl]-2-phenylacetamide | C29H38N2O

N-[(3s,5s,7s)-Adamantan-1-yl]-N-[4-(diethylamino)benzyl]-2-phenylacetamide

  • Molecular FormulaC29H38N2O
  • Average mass430.625 Da
  • Monoisotopic mass430.298401 Da
  • ChemSpider ID29409505

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Benzeneacetamide, N-[[4-(diethylamino)phenyl]methyl]-N-tricyclo[3.3.1.13,7]dec-1-yl- [ACD/Index Name]
N-[(3s,5s,7s)-Adamantan-1-yl]-N-[4-(diethylamino)benzyl]-2-phenylacetamid [German] [ACD/IUPAC Name]
N-[(3s,5s,7s)-Adamantan-1-yl]-N-[4-(diethylamino)benzyl]-2-phenylacetamide [ACD/IUPAC Name]
N-[(3s,5s,7s)-Adamantan-1-yl]-N-[4-(diéthylamino)benzyl]-2-phénylacétamide [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: 597.3±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 243.5±19.4 °C
Index of Refraction: 1.607
Molar Refractivity: 131.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.83
ACD/LogD (pH 5.5): 5.46
ACD/BCF (pH 5.5): 5182.07
ACD/KOC (pH 5.5): 9052.37
ACD/LogD (pH 7.4): 6.28
ACD/BCF (pH 7.4): 34562.35
ACD/KOC (pH 7.4): 60375.66
Polar Surface Area: 24 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 50.2±5.0 dyne/cm
Molar Volume: 381.8±5.0 cm3

Click to predict properties on the Chemicalize site


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