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Substance Name: 1-Piperazinepropanamide, 4-(6-methoxy-2-pyridinyl)-N-(2-nitrophenyl)-, monohydrochloride
RN: 104373-66-2
InChIKey: XDMJZWCNVPBYHD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-N5-O4.Cl-H

Molecular Weight

  • 421.8826
 
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Names and Synonyms

Synonym

  • 4-(6-Methoxy-2-pyridinyl)-N-(2-nitrophenyl)-1-piperazinepropanamide, monohydrochloride

Systematic Name

  • 1-Piperazinepropanamide, 4-(6-methoxy-2-pyridinyl)-N-(2-nitrophenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 104373-66-2

System Generated Number

  • 0104373662

Molecular Formulas

Molecular Formula

  • C19-H23-N5-O4.Cl-H

Molecular Formula Fragments

  • C19-H23-N5-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H23N5O4.ClH/c1-28-19-8-4-5-14(21-19)17-13-23(12-11-22(17)10-9-18(20)25)15-6-2-3-7-16(15)24(26)27;/h2-8,17H,9-13H2,1H3,(H2,20,25);1H

InChIKey

XDMJZWCNVPBYHD-UHFFFAOYSA-N

Smiles

COc1cccc(n1)C2CN(CCN2CCC(=O)N)c3ccccc3[N+](=O)[O-].Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2995mg/kg (2995mg/kg)   Journal of Medicinal Chemistry. Vol. 30, Pg. 13, 1987.