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Substance Name: 1-Piperazineethanamine, alpha-methyl-4-(1-methylethyl)-N-phenyl-, ethanedioate (1:2)
RN: 77562-86-8
InChIKey: KPYYDRPIAPGETN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H27-N3.2C2-H2-O4

Molecular Weight

  • 441.4779
 
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Names and Synonyms

Synonym

  • N-(1-Methyl-2-(4-isopropylpiperazino)ethyl)aniline dioxalate

Systematic Name

  • 1-Piperazineethanamine, alpha-methyl-4-(1-methylethyl)-N-phenyl-, ethanedioate (1:2)

Registry Numbers

CAS Registry Number

  • 77562-86-8

System Generated Number

  • 0077562868

Molecular Formulas

Molecular Formula

  • C16-H27-N3.2C2-H2-O4

Molecular Formula Fragments

  • C16-H27-N3
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H27N3.2C2H2O4/c1-13(2)16-12-18(15-7-5-4-6-8-15)9-10-19(16)11-14(3)17;2*3-1(4)2(5)6/h4-8,13-14,16H,9-12,17H2,1-3H3;2*(H,3,4)(H,5,6)

InChIKey

KPYYDRPIAPGETN-UHFFFAOYSA-N

Smiles

CC(C)C1CN(CCN1CC(C)N)c2ccccc2.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD subcutaneous > 300mg/kg (300mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 28, Pg. 3315, 1980.