N-{[1-Methyl-5-(4-Methylbenzoyl)-1H-Pyrrol-2-Yl]Acetyl}Glycine

Molecule SVG Image

Properties Simple | Detailed

Formula C17H18N2O4
IUPAC Name 2-[[2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetyl]amino]acetic acid
Molecular Mass 314.336 g·mol−1
Heat of Formation -547.6 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 372.29 Å 3
Surface Area 333.22 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.71 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-[1-methyl-5-(4-methylphenyl)carbonyl-pyrrol-2-yl]ethanoylamino]ethanoic acid
  • 2-[[2-[1-methyl-5-[(4-methylphenyl)-oxomethyl]-2-pyrrolyl]-1-oxoethyl]amino]acetic acid
  • glycine, n-((1-methyl-5-(4-methylbenzoyl)-1h-pyrrol-2-yl)acetyl)-
  • mcn 4366
  • mcn-4366
  • tolmetin glycinamide
  • tolmetin glycine amide
  • tolmetin glycineamide
CAS Number(s)
  • 87344-05-6
InChIKey IYNXNYQOVKPFMM-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N