2-{(Z)-[5-(Hydroxymethyl)-3H-Indol-3-Ylidene]Methyl}-N'-Pentylhydrazinecarboximidamide

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Properties Simple | Detailed

Formula C16H23N5O
IUPAC Name 1-[[(z)-[5-(hydroxymethyl)indol-1-ium-5-id-3-ylidene]methyl]amino]-2-pentyl-guanidine
Molecular Mass 301.387 g·mol−1
Heat of Formation 147.4 ± 16.7 kJ·mol−1
Dipole Moment 5.40 ± 1.08 D
Volume 396.33 Å 3
Surface Area 329.59 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[[(z)-[5-(hydroxymethyl)-3-indolylidene]methyl]amino]-2-pentylguanidine
  • 1-[[(z)-[5-(hydroxymethyl)indol-3-ylidene]methyl]amino]-2-pentyl-guanidine
  • 1-[[(z)-[5-(hydroxymethyl)indol-3-ylidene]methyl]amino]-2-pentylguanidine
  • 2-amyl-1-[[(z)-(5-methylolindol-3-ylidene)methyl]amino]guanidine
  • hydrazinecarboximidamide, 2-((5-methoxy-1h-indol-3-yl)methylene)-n-pentyl-
  • pdsp1_001758
  • pdsp2_001741
  • sdz htf 919
  • tegaserod
InChIKey URPUECXJHQGUDU-JLHYYAGUSA-N
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