U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C19H28N2O3
Molecular Weight 332.4372
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IROLAPRIDE

SMILES

CCCC(=O)C1=CC=C(OC)C(=C1)C(=O)NCC2CCCN2CC

InChI

InChIKey=XTJJMMJFYXQXOT-UHFFFAOYSA-N
InChI=1S/C19H28N2O3/c1-4-7-17(22)14-9-10-18(24-3)16(12-14)19(23)20-13-15-8-6-11-21(15)5-2/h9-10,12,15H,4-8,11,13H2,1-3H3,(H,20,23)

HIDE SMILES / InChI
Name Type Language
(±)-5-BUTYRYL-N-((1-ETHYL-2-PYRROLIDINYL)METHYL)-O-ANISAMIDE
Preferred Name English
IROLAPRIDE
INN  
INN  
Official Name English
irolapride [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C265
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
Code System Code Type Description
FDA UNII
JS492IR8Z6
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
INN
5600
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
PUBCHEM
3038473
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
SMS_ID
100000083375
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
EVMPD
SUB08297MIG
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
CAS
64779-98-2
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
EPA CompTox
DTXSID40867098
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
ChEMBL
CHEMBL2106781
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY
NCI_THESAURUS
C65962
Created by admin on Mon Mar 31 18:21:09 GMT 2025 , Edited by admin on Mon Mar 31 18:21:09 GMT 2025
PRIMARY