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Substance Name: 1H-Azepine-1-acetamide, hexahydro-N-(2,6-dimethylphenyl)-alpha-ethyl-, monohydrochloride
RN: 118564-55-9
InChIKey: GUEVUIKHBVKSEI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H28-N2-O.Cl-H

Molecular Weight

  • 324.8931
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 118564-55-9

System Generated Number

  • 0118564559

Molecular Formulas

Molecular Formula

  • C18-H28-N2-O.Cl-H

Molecular Formula Fragments

  • C18-H28-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H28N2O.ClH/c1-4-16(20-12-7-5-6-8-13-20)18(21)19-17-14(2)10-9-11-15(17)3;/h9-11,16H,4-8,12-13H2,1-3H3,(H,19,21);1H

InChIKey

GUEVUIKHBVKSEI-UHFFFAOYSA-N

Smiles

CCC(C(=O)Nc1c(cccc1C)C)N2CCCCCC2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 88mg/kg (88mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 79, 1991.