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Substance Name: 1H-Azepine-1-propanamine, hexahydro-N,N-bis(2-methylphenyl)-, hydrochloride
RN: 64633-39-2
InChIKey: NRPJNYMLCXSKGT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H32-N2.Cl-H

Molecular Weight

  • 372.9807
 
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Names and Synonyms

Synonym

  • Hexahydro-N,N-bis(2-methylphenyl)-1H-azepine-1-propanamine hydrochloride

Systematic Name

  • 1H-Azepine-1-propanamine, hexahydro-N,N-bis(2-methylphenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 64633-39-2

System Generated Number

  • 0064633392

Molecular Formulas

Molecular Formula

  • C23-H32-N2.Cl-H

Molecular Formula Fragments

  • C23-H32-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H32N2.ClH/c1-20-12-5-7-14-22(20)25(23-15-8-6-13-21(23)2)19-11-18-24-16-9-3-4-10-17-24;/h5-8,12-15H,3-4,9-11,16-19H2,1-2H3;1H

InChIKey

NRPJNYMLCXSKGT-UHFFFAOYSA-N

Smiles

Cc1ccccc1N(CCCN2CCCCCC2)c3ccccc3C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 371, 1977.
mouse LDLo oral 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 371, 1977.