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Substance Name: Acetamide, N-(2,5-dimethyl-1H-pyrrol-1-yl)-2-(3-pentadecylphenoxy)-
RN: 117554-50-4
InChIKey: FOMXXYYRAAYBQV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H46-N2-O2

Molecular Weight

  • 454.6944
 
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Names and Synonyms

Synonyms

  • 1-(3-Pentadecylphenoxyacetamido)-2,5-dimethylpyrrole
  • BRN 5153511
  • N-(2,5-Dimethyl-1H-pyrrol-1-yl)-2-(3-pentadecylphenoxy)acetamide

Systematic Name

  • Acetamide, N-(2,5-dimethyl-1H-pyrrol-1-yl)-2-(3-pentadecylphenoxy)-

Registry Numbers

CAS Registry Number

  • 117554-50-4

System Generated Number

  • 0117554504

Structure Descriptors

InChI

1S/C29H46N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-27-19-17-20-28(23-27)33-24-29(32)30-31-25(2)21-22-26(31)3/h17,19-23H,4-16,18,24H2,1-3H3,(H,30,32)

InChIKey

FOMXXYYRAAYBQV-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCc1cccc(c1)OCC(=O)Nn2c(ccc2C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 26, Pg. 1204, 1987.