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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H14ClN3O
Molecular Weight 251.712
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-CHLORO-1-(4-PIPERIDINYL)-2-BENZIMIDAZOLINONE

SMILES

ClC1=CC=C2N(C3CCNCC3)C(=O)NC2=C1

InChI

InChIKey=DOAYWDKFDPSTSV-UHFFFAOYSA-N
InChI=1S/C12H14ClN3O/c13-8-1-2-11-10(7-8)15-12(17)16(11)9-3-5-14-6-4-9/h1-2,7,9,14H,3-6H2,(H,15,17)

HIDE SMILES / InChI

Molecular Formula C12H14ClN3O
Molecular Weight 251.712
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:44:35 GMT 2023
Edited
by admin
on Sat Dec 16 08:44:35 GMT 2023
Record UNII
53TAT94YDS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-CHLORO-1-(4-PIPERIDINYL)-2-BENZIMIDAZOLINONE
Systematic Name English
R29676
Code English
4-(6-CHLORO-1,2-DIHYDRO-2-OXOBENZO(D)IMIDAZOL-3-YL)PIPERIDINE
Systematic Name English
2H-BENZIMIDAZOL-2-ONE, 5-CHLORO-1,3-DIHYDRO-1-(4-PIPERIDINYL)-
Systematic Name English
DOMPERIDONE IMPURITYA [EP IMPURITY]
Common Name English
5-CHLORO-1-(4-PIPERIDINYL)-1,3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE
Systematic Name English
5-CHLORO-1-(PIPERIDIN-4-YL)-1,3-DIHYDRO-2H-BENZIMIDAZOL-2-ONE
Systematic Name English
R-29676
Code English
Code System Code Type Description
EPA CompTox
DTXSID4057764
Created by admin on Sat Dec 16 08:44:35 GMT 2023 , Edited by admin on Sat Dec 16 08:44:35 GMT 2023
PRIMARY
ECHA (EC/EINECS)
258-771-6
Created by admin on Sat Dec 16 08:44:35 GMT 2023 , Edited by admin on Sat Dec 16 08:44:35 GMT 2023
PRIMARY
CAS
53786-28-0
Created by admin on Sat Dec 16 08:44:35 GMT 2023 , Edited by admin on Sat Dec 16 08:44:35 GMT 2023
PRIMARY
FDA UNII
53TAT94YDS
Created by admin on Sat Dec 16 08:44:35 GMT 2023 , Edited by admin on Sat Dec 16 08:44:35 GMT 2023
PRIMARY
PUBCHEM
104607
Created by admin on Sat Dec 16 08:44:35 GMT 2023 , Edited by admin on Sat Dec 16 08:44:35 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
Related Record Type Details
PARENT -> IMPURITY
PARENT -> IMPURITY