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Substance Name: Adamantane, 1-(3-dimethylaminobutyl)-, hydrochloride
RN: 52582-86-2
InChIKey: QUCYHTNWCIUCRQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H29-N.Cl-H

Molecular Weight

  • 271.873
 
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Names and Synonyms

Synonym

  • 2-Butylamine, 4-(1-adamantyl)-N,N-dimethyl-, hydrochloride

Systematic Name

  • Adamantane, 1-(3-dimethylaminobutyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 52582-86-2

System Generated Number

  • 0052582862

Molecular Formulas

Molecular Formula

  • C16-H29-N.Cl-H

Molecular Formula Fragments

  • C16-H29-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H29N.ClH/c1-12(17(2)3)4-5-16-9-13-6-14(10-16)8-15(7-13)11-16;/h12-15H,4-11H2,1-3H3;1H

InChIKey

QUCYHTNWCIUCRQ-UHFFFAOYSA-N

Smiles

C1C2CC3(CC(C2)CC1C3)CC[C@@H](N(C)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 75mg/kg (75mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 17, Pg. 602, 1974.
mouse LD50 oral 400mg/kg (400mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 17, Pg. 602, 1974.