5-Oxo-L-Prolyl-D-Alaninamide

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Properties Simple | Detailed

Formula C8H13N3O3
IUPAC Name (2s)-n-[(1r)-2-amino-1-methyl-2-oxo-ethyl]-5-oxo-pyrrolidine-2-carboxamide
Molecular Mass 199.207 g·mol−1
Heat of Formation -588.1 ± 16.7 kJ·mol−1
Dipole Moment 5.67 ± 1.08 D
Volume 239.23 Å 3
Surface Area 226.97 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 0.67 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(1r)-2-amino-1-methyl-2-oxo-ethyl]-5-oxo-pyrrolidine-2-carboxamide
  • (2s)-n-[(1r)-2-amino-1-methyl-2-oxoethyl]-5-oxo-2-pyrrolidinecarboxamide
  • (2s)-n-[(1r)-2-amino-2-keto-1-methyl-ethyl]-5-keto-pyrrolidine-2-carboxamide
  • (2s)-n-[(2r)-1-amino-1-oxo-propan-2-yl]-5-oxo-pyrrolidine-2-carboxamide
  • (2s)-n-[(2r)-1-amino-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
  • d-alainamdie, 5-oxo-l-prolyl-
  • pyroglutamylalanine amide
CAS Number(s)
  • 100462-32-6
InChIKey CLNSLBYOSNFAOC-UHNVWZDZSA-N
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