Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ketone, phenyl 1-(2-piperidinopropyl)pyrrol-2-yl, citrate
RN: 14415-59-9
InChIKey: QHRCCELKJAFVAF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-N2-O.C6-H8-O7

Molecular Weight

  • 488.534
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 1-(2-(2-Benzoyl-1-pyrrolidinyl)-1-methylethyl)piperidine citrate

Systematic Name

  • Ketone, phenyl 1-(2-piperidinopropyl)pyrrol-2-yl, citrate

Registry Numbers

CAS Registry Number

  • 14415-59-9

System Generated Number

  • 0014415599

Molecular Formulas

Molecular Formula

  • C19-H24-N2-O.C6-H8-O7

Molecular Formula Fragments

  • C19-H24-N2-O
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C19H24N2O.C6H8O7/c1-16(20-12-6-3-7-13-20)15-21-14-8-11-18(21)19(22)17-9-4-2-5-10-17;7-3(8)1-6(13,5(11)12)2-4(9)10/h2,4-5,8-11,14,16H,3,6-7,12-13,15H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey

QHRCCELKJAFVAF-UHFFFAOYSA-N

Smiles

c1(n(C[C@@H]([NH+]2CCCCC2)C)ccc1)C(c1ccccc1)=O.C(CC(O)=O)(CC(O)=O)(C(=O)[O-])O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 17mg/kg (17mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Chimica Therapeutica. Vol. 1, Pg. 127, 1966.