4-(Dimethylamino)-N-(2,6-Dimethylphenyl)-1-[(1S,2S)-2-Hydroxycyclohexyl]-4-Piperidinecarboxamide

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Properties Simple | Detailed

Formula C22H35N3O2
IUPAC Name 4-(dimethylamino)-n-(2,6-dimethylphenyl)-1-[(1s,2s)-2-hydroxycyclohexyl]piperidine-4-carboxamide
Molecular Mass 373.532 g·mol−1
Heat of Formation -389.4 ± 16.7 kJ·mol−1
Dipole Moment 3.27 ± 1.08 D
Volume 481.97 Å 3
Surface Area 380.71 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 0.30 ± eV
Point Group Symmetry C1
Synonyms
  • 4-dimethylamino-n-(2,6-dimethylphenyl)-1-[(1s,2s)-2-hydroxycyclohexyl]-4-piperidinecarboxamide
  • 4-dimethylamino-n-(2,6-dimethylphenyl)-1-[(1s,2s)-2-hydroxycyclohexyl]isonipecotamide
  • 4-dimethylamino-n-(2,6-dimethylphenyl)-1-[(1s,2s)-2-hydroxycyclohexyl]piperidine-4-carboxamide
  • r-54718
InChIKey MFKCGXDCHAFQQZ-OALUTQOASA-N
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