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Substance Name: 3-Pyrrolidinecarboxamide, N-(3-(((2-allyloxyphenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride
RN: 102132-39-8
InChIKey: HCRXJLRGVUDEHQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H35-N3-O2.2Cl-H

Molecular Weight

  • 446.4593
 
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Names and Synonyms

  • 3-Pyrrolidinecarboxamide, N-(3-(((2-allyloxyphenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 102132-39-8

System Generated Number

  • 0102132398

Molecular Formulas

Molecular Formula

  • C22-H35-N3-O2.2Cl-H

Molecular Formula Fragments

  • C22-H35-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H35N3O2.2ClH/c1-6-14-27-19-11-8-7-10-17(19)16-23-12-9-13-24-20(26)18-15-21(2,3)25-22(18,4)5;;/h6-8,10-11,18,23,25H,1,9,12-16H2,2-5H3,(H,24,26);2*1H

InChIKey

HCRXJLRGVUDEHQ-UHFFFAOYSA-N

Smiles

CC1(CC(C(N1)(C)C)C(=O)NCCCNCc2ccccc2OCC=C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 13mg/kg (13mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.