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Substance Name: Nicotinamide, N-(1-adamantylmethyl)-, 1-oxide, hydrochloride
RN: 61876-42-4
InChIKey: YVKSVPQVOMGOIU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H22-N2-O2.Cl-H

Molecular Weight

  • 322.834
 
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Names and Synonyms

Synonyms

  • 3-Pyridinecarboxamide, N-(tricyclo(3.3.1.1(sup 3,7))dec-1-ylmethyl)-, 1-oxide, hydrochloride
  • N-(1-Adamantylmethyl)nicotinamide 1-oxide hydrochloride

Systematic Name

  • Nicotinamide, N-(1-adamantylmethyl)-, 1-oxide, hydrochloride

Registry Numbers

CAS Registry Number

  • 61876-42-4

System Generated Number

  • 0061876424

Molecular Formulas

Molecular Formula

  • C17-H22-N2-O2.Cl-H

Molecular Formula Fragments

  • C17-H22-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H22N2O2.ClH/c20-16(15-2-1-3-19(21)10-15)18-11-17-7-12-4-13(8-17)6-14(5-12)9-17;/h1-3,10,12-14H,4-9,11H2,(H,18,20);1H

InChIKey

YVKSVPQVOMGOIU-UHFFFAOYSA-N

Smiles

Cl.C1C2(CC3CC(C2)CC1C3)CNC(c1cccn(c1)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 265mg/kg (265mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 1036, 1976.