N-[(2S)-2-Acetamidopropanoyl]-1-[(3S)-1,1,1-Trifluoro-4-Methyl-2-Oxo-3-Pentanyl]-L-Prolinamide

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Properties Simple | Detailed

Formula C16H24F3N3O4
IUPAC Name (2s)-n-[(2s)-2-acetamidopropanoyl]-1-[(1s)-3,3,3-trifluoro-1-isopropyl-2-oxo-propyl]pyrrolidine-2-carboxamide
Molecular Mass 379.375 g·mol−1
Heat of Formation -1404.0 ± 16.7 kJ·mol−1
Dipole Moment 2.93 ± 1.08 D
Volume 446.32 Å 3
Surface Area 363.7 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-n-[(2s)-2-acetamido-1-oxopropyl]-1-[(1s)-3,3,3-trifluoro-1-isopropyl-2-oxopropyl]-2-pyrrolidinecarboxamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-1-[(1s)-3,3,3-trifluoro-1-isopropyl-2-keto-propyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-1-[(1s)-3,3,3-trifluoro-1-isopropyl-2-oxo-propyl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-1-[(3s)-1,1,1-trifluoro-4-methyl-2-oxo-pentan-3-yl]pyrrolidine-2-carboxamide
  • (2s)-n-[(2s)-2-acetamidopropanoyl]-1-[(3s)-1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl]pyrrolidine-2-carboxamide
  • (s)-n-acetyl-l-alanyl-n-(3,3,3-trifluoro-1-(1-methylethyl)-2-oxopropyl)-l-prolinamide
  • ac-ala-pro-val-trifluoromethyl ketone
  • acetylalanyl-prolyl-valyl-trifluoromethyl ketone
  • apv-tfmk
  • l-prolinamide, n-acetyl-l-alanyl-n-(3,3,3-trifluoro-1-(1-methylethyl)-2-oxopropyl)-, (s)-
  • trifluromethyl ketone, acetyl-alanyl-prolyl-valyl-
CAS Number(s)
  • 116380-62-2
InChIKey HEOADFSIIIRXGH-DLOVCJGASA-N
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