Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Azepine-1-acetamide, hexahydro-N-(2,4,6-trimethylphenyl)-, monohydrochloride
RN: 118564-51-5
InChIKey: LUWMGRDFLACVSV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H26-N2-O.Cl-H

Molecular Weight

  • 310.8663
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • N-(2,4,6-Trimethylphenyl)-1H-hexahydroazepine-1-acetamide monohydrochloride

Systematic Name

  • 1H-Azepine-1-acetamide, hexahydro-N-(2,4,6-trimethylphenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 118564-51-5

System Generated Number

  • 0118564515

Molecular Formulas

Molecular Formula

  • C17-H26-N2-O.Cl-H

Molecular Formula Fragments

  • C17-H26-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H26N2O.ClH/c1-13-10-14(2)17(15(3)11-13)18-16(20)12-19-8-6-4-5-7-9-19;/h10-11H,4-9,12H2,1-3H3,(H,18,20);1H

InChIKey

LUWMGRDFLACVSV-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(c1)C)NC(=O)CN2CCCCCC2)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 132mg/kg (132mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 79, 1991.