1-Methyl-N~5~-{3-[3-(1-Piperidinylmethyl)Phenoxy]Propyl}-1H-1,2,4-Triazole-3,5-Diamine

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Properties Simple | Detailed

Formula C18H28N6O
IUPAC Name 1-methyl-n5-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-4-aza-1-azonia-2-azanidacyclopenta-3,5-diene-3,5-diamine
Molecular Mass 344.455 g·mol−1
Heat of Formation 99.4 ± 16.7 kJ·mol−1
Dipole Moment 3.84 ± 1.08 D
Volume 440.52 Å 3
Surface Area 335.07 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (5-amino-2-methyl-1,2,4-triazol-3-yl)-[3-[3-(piperidinomethyl)phenoxy]propyl]amine
  • 1-(m-(3-((3-amino-1-methyl-1h-1,2,4-triazol-5-yl)amino)propoxy)benzyl)piperidine
  • 1-methyl-n'-[3-[3-(1-piperidylmethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine
  • 1-methyl-n'-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine
  • ah 22216
  • lamtidina [spanish]
  • lamtidine
  • lamtidine [ban:inn]
  • lamtidinum [latin]
CAS Number(s)
  • 73278-54-3
InChIKey NRIGRKAXOLMTSK-UHFFFAOYSA-N
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