N-[(1R)-2-(Benzyloxy)-1-Cyanoethyl]-N~2~-(4-Morpholinylcarbonyl)-L-Leucinamide

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Properties Simple | Detailed

Formula C21H30N4O4
IUPAC Name n-[(1s)-1-[[(1r)-2-benzyloxy-1-cyano-ethyl]carbamoyl]-3-methyl-butyl]morpholine-4-carboxamide
Molecular Mass 402.487 g·mol−1
Heat of Formation -588.5 ± 16.7 kJ·mol−1
Dipole Moment 1.43 ± 1.08 D
Volume 508.22 Å 3
Surface Area 389.95 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy 2.91 ± eV
Point Group Symmetry C1
Synonyms
  • bln
  • morpholine-4-carboxylic acid [1s-(2-benzyloxy-1r-cyano-ethylcarbamoyl)-3-methyl-butyl]amide
  • morpholine-4-carboxylic acid [1s-(2-benzyloxy-1r-cyano-ethylcarbamoyl)-3-methylbutyl]amide
  • n-[(1s)-1-[[(1r)-1-cyano-2-(phenylmethoxy)ethyl]carbamoyl]-3-methyl-butyl]morpholine-4-carboxamide
  • n-[(1s)-1-[[(1r)-2-(benzyloxy)-1-cyano-ethyl]carbamoyl]-3-methyl-butyl]morpholine-4-carboxamide
  • n-[(1s)-1-[[[(1r)-1-cyano-2-(phenylmethoxy)ethyl]amino]-oxomethyl]-3-methylbutyl]-4-morpholinecarboxamide
  • n-[(2s)-1-[[(1r)-1-cyano-2-(phenylmethoxy)ethyl]amino]-4-methyl-1-oxo-pentan-2-yl]morpholine-4-carboxamide
InChIKey LXEDKIMJQBOMSU-MOPGFXCFSA-N
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