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Substance Name: 1-Piperidineacetanilide, 4'-nitro-
RN: 38367-22-5
InChIKey: UZQWAYFXMZILIT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-N3-O3

Molecular Weight

  • 263.2953
 
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Names and Synonyms

Synonyms

  • 1-Piperidineacetamide, N-(4-nitrophenyl)-
  • 4'-Nitro-1-piperidineacetanilide
  • 5-20-03-00009 (Beilstein Handbook Reference)
  • BRN 0260214
  • IEM-208

Systematic Name

  • 1-Piperidineacetanilide, 4'-nitro-

Registry Numbers

CAS Registry Number

  • 38367-22-5

System Generated Number

  • 0038367225

Structure Descriptors

InChI

1S/C13H17N3O3/c17-13(10-15-8-2-1-3-9-15)14-11-4-6-12(7-5-11)16(18)19/h4-7H,1-3,8-10H2,(H,14,17)

InChIKey

UZQWAYFXMZILIT-UHFFFAOYSA-N

Smiles

c1cc(ccc1NC(=O)CN2CCCCC2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 118mg/kg (118mg/kg) BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: EXCITEMENT
Farmakologiya i Toksikologiya Vol. 24, Pg. 40, 1961.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.72 (none)   EXP
Water Solubility 38.6 mg/L 25 EST
Vapor Pressure 1.66E-08 mm Hg 25 EST
Henry's Law Constant 2.49E-13 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.97E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.