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Substance Name: 1H-Azepine-1-acetamide, hexahydro-N-(2,6-dimethylphenyl)-, monohydrochloride
RN: 86574-32-5
InChIKey: KSBWLYWJTVBEIK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N2-O.Cl-H

Molecular Weight

  • 296.8395
 
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Names and Synonyms

Synonym

  • N-(2,6-Dimethylphenyl)-1H-hexahydroazepine-1-acetamide monohydrochloride

Systematic Name

  • 1H-Azepine-1-acetamide, hexahydro-N-(2,6-dimethylphenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 86574-32-5

System Generated Number

  • 0086574325

Molecular Formulas

Molecular Formula

  • C16-H24-N2-O.Cl-H

Molecular Formula Fragments

  • C16-H24-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H24N2O.ClH/c1-13-8-7-9-14(2)16(13)17-15(19)12-18-10-5-3-4-6-11-18;/h7-9H,3-6,10-12H2,1-2H3,(H,17,19);1H

InChIKey

KSBWLYWJTVBEIK-UHFFFAOYSA-N

Smiles

Cc1cccc(c1NC(=O)CN2CCCCCC2)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 106mg/kg (106mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 79, 1991.