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Substance Name: 1-Propanamine, N,N-dimethyl-3-((5-phenyl-1H-pyrazol-3-yl)oxy)-, (Z)-2-butenedioate (1:1)
RN: 86871-57-0
InChIKey: JTLYPEQHOMGUCR-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-N3-O.C4-H4-O4

Molecular Weight

  • 361.3957
 
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Names and Synonyms

Synonyms

  • 3-(3-(Dimethylamino)propoxy)-5-phenylpyrazole maleate
  • N,N-Dimethyl-3-((5-phenyl-1H-pyrazol-3-yl)oxy)-1-propanamine (Z)-2-butenedioate (1:1)

Systematic Name

  • 1-Propanamine, N,N-dimethyl-3-((5-phenyl-1H-pyrazol-3-yl)oxy)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 86871-57-0

System Generated Number

  • 0086871570

Molecular Formulas

Molecular Formula

  • C14-H19-N3-O.C4-H4-O4

Molecular Formula Fragments

  • C14-H19-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H19N3O.C4H4O4/c1-17(2)9-6-10-18-14-11-13(15-16-14)12-7-4-3-5-8-12;5-3(6)1-2-4(7)8/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,15,16);1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

JTLYPEQHOMGUCR-WLHGVMLRSA-N

Smiles

CN(C)CCCOc1cc([nH]n1)c2ccccc2.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0076756,