N-{[(2R,3R,4R,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]Methyl}-4-(Dimethylamino)Benzamide

Molecule SVG Image

Properties Simple | Detailed

Formula C15H23N3O4
IUPAC Name n-[[(2r,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-(dimethylamino)benzamide
Molecular Mass 309.361 g·mol−1
Heat of Formation -635.9 ± 16.7 kJ·mol−1
Dipole Moment 4.77 ± 1.08 D
Volume 378.17 Å 3
Surface Area 335.88 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy -0.27 ± eV
Point Group Symmetry C1
Synonyms
  • mni
  • n-[[(2r,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)-2-pyrrolidinyl]methyl]-4-dimethylaminobenzamide
  • n-[[(2r,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-dimethylamino-benzamide
  • n-[[(2r,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]methyl]-4-dimethylaminobenzamide
  • n-[[(2r,3r,4r,5r)-3,4-dihydroxy-5-methylol-pyrrolidin-2-yl]methyl]-4-dimethylamino-benzamide
InChIKey OULLPOCYJLHTGG-AAVRWANBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N