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Substance Name: 1-Piperidineacetamide, N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-
RN: 54087-49-9
InChIKey: HOQLGIUIKZYHCD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H29-N3-O2

Molecular Weight

  • 391.5121
 
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Names and Synonyms

Synonyms

  • 5-22-13-00145 (Beilstein Handbook Reference)
  • BRN 0501144
  • N-(4-(1,2,3,4-Tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-1-piperidineacetamide

Systematic Name

  • 1-Piperidineacetamide, N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 54087-49-9

System Generated Number

  • 0054087499

Structure Descriptors

InChI

1S/C24H29N3O2/c1-24(2)20-9-5-4-8-19(20)22(26-23(24)29)17-10-12-18(13-11-17)25-21(28)16-27-14-6-3-7-15-27/h4-5,8-13,22H,3,6-7,14-16H2,1-2H3,(H,25,28)(H,26,29)

InChIKey

HOQLGIUIKZYHCD-UHFFFAOYSA-N

Smiles

CC1(c2ccccc2C(NC1=O)c3ccc(cc3)NC(=O)CN4CCCCC4)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1384, 1977.