N-[(1S,4R,5R,7S)-5-(3-Hydroxyphenyl)-4-Methyl-2-(3-Phenylpropyl)-2-Azabicyclo[3.3.1]Non-7-Yl]-2-Methyl-2-Phenylpropanamide

Molecule SVG Image

Properties Simple | Detailed

Formula C34H42N2O2
IUPAC Name n-[(1r,3s,5s,8r)-1-(3-hydroxyphenyl)-8-methyl-6-(3-phenylpropyl)-6-azabicyclo[3.3.1]nonan-3-yl]-2-methyl-2-phenylpropanamide
Molecular Mass 510.709 g·mol−1
Heat of Formation -223.0 ± 16.7 kJ·mol−1
Dipole Moment 3.97 ± 1.08 D
Volume 660.53 Å 3
Surface Area 537.0 Å 2
HOMO Energy -8.64 ± 0.55 eV
LUMO Energy 3.11 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(1r,3s,5s,8r)-1-(3-hydroxyphenyl)-8-methyl-6-(3-phenylpropyl)-6-azabicyclo[3.3.1]nonan-3-yl]-2-methyl-2-phenyl-propanamide
  • n-[(1r,3s,5s,8r)-1-(3-hydroxyphenyl)-8-methyl-6-(3-phenylpropyl)-6-azabicyclo[3.3.1]nonan-3-yl]-2-methyl-2-phenyl-propionamide
InChIKey YEFGMGCEOZCNNZ-POBAWSAGSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N