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Substance Name: Nicotinamide, N-(1-(1-adamantyl)ethyl)-, 1-oxide, hydrochloride
RN: 61876-41-3
InChIKey: YCGOBNBDMFKPQV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H24-N2-O2.Cl-H

Molecular Weight

  • 336.861
 
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Names and Synonyms

Synonyms

  • 3-Pyridinecarboxamide, N-(1-tricyclo(3.3.1.1(sup 3,7))dec-1-ylethyl)-, 1-oxide, hydrochloride
  • N-(1-(1-Adamantyl)ethyl)nicotinamide 1-oxide hydrochloride

Systematic Name

  • Nicotinamide, N-(1-(1-adamantyl)ethyl)-, 1-oxide, hydrochloride

Registry Numbers

CAS Registry Number

  • 61876-41-3

System Generated Number

  • 0061876413

Molecular Formulas

Molecular Formula

  • C18-H24-N2-O2.Cl-H

Molecular Formula Fragments

  • C18-H24-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H24N2O2.ClH/c1-12(19-17(21)16-3-2-4-20(22)11-16)18-8-13-5-14(9-18)7-15(6-13)10-18;/h2-4,11-15H,5-10H2,1H3,(H,19,21);1H

InChIKey

YCGOBNBDMFKPQV-UHFFFAOYSA-N

Smiles

Cl.C1C2(CC3CC1CC(C3)C2)[C@@H](NC(c1cccn(c1)=O)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 165mg/kg (165mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 1036, 1976.