Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Pyrrolidinone, 1-(4-(3a,4,7,7a-tetrahydro-2-isoindolinyl)-2-butynyl)-
RN: 14053-09-9
InChIKey: ISKILFGLUIDQFS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H22-N2-O

Molecular Weight

  • 258.363
 
* 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

Synonyms

  • 1-(4-(3a,4,7,7a-Tetrahydro-2-isoindolinyl)-2-butynyl)-2-pyrrolidinone
  • 5-21-06-00371 (Beilstein Handbook Reference)
  • BRN 1476764

Systematic Name

  • 2-Pyrrolidinone, 1-(4-(3a,4,7,7a-tetrahydro-2-isoindolinyl)-2-butynyl)-

Registry Numbers

CAS Registry Number

  • 14053-09-9

System Generated Number

  • 0014053099

Structure Descriptors

InChI

1S/C16H22N2O/c19-16-8-5-11-18(16)10-4-3-9-17-12-14-6-1-2-7-15(14)13-17/h1-2,14-15H,5-13H2

InChIKey

ISKILFGLUIDQFS-UHFFFAOYSA-N

Smiles

N1(C(CCC1)=O)CC#CCN1C[C@@H]2CC=CC[C@@H]2C1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg) BEHAVIORAL: TREMOR

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Journal of Medicinal Chemistry. Vol. 10, Pg. 615, 1967.