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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H7N.ClH
Molecular Weight 129.587
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-PICOLINIUM CHLORIDE

SMILES

Cl.CC1=CC=CC=N1

InChI

InChIKey=OMSBSIXAZZRIRW-UHFFFAOYSA-N
InChI=1S/C6H7N.ClH/c1-6-4-2-3-5-7-6;/h2-5H,1H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H7N
Molecular Weight 93.1265
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
50.0 nM [Kd]
Substance Class Chemical
Created
by admin
on Tue Apr 01 20:30:01 GMT 2025
Edited
by admin
on Tue Apr 01 20:30:01 GMT 2025
Record UNII
2TY2V9A7GW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-PICOLINIUM CHLORIDE
Common Name English
2-METHYLPYRIDINIUM CHLORIDE
Preferred Name English
2-METHYLPYRIDINE HYDROCHLORIDE
Systematic Name English
2-PICOLINE MONOHYDROCHLORIDE
Common Name English
Code System Code Type Description
CAS
14401-91-3
Created by admin on Tue Apr 01 20:30:01 GMT 2025 , Edited by admin on Tue Apr 01 20:30:01 GMT 2025
PRIMARY
FDA UNII
2TY2V9A7GW
Created by admin on Tue Apr 01 20:30:01 GMT 2025 , Edited by admin on Tue Apr 01 20:30:01 GMT 2025
PRIMARY
PUBCHEM
518938
Created by admin on Tue Apr 01 20:30:01 GMT 2025 , Edited by admin on Tue Apr 01 20:30:01 GMT 2025
PRIMARY
ECHA (EC/EINECS)
238-367-6
Created by admin on Tue Apr 01 20:30:01 GMT 2025 , Edited by admin on Tue Apr 01 20:30:01 GMT 2025
PRIMARY
EPA CompTox
DTXSID90162601
Created by admin on Tue Apr 01 20:30:01 GMT 2025 , Edited by admin on Tue Apr 01 20:30:01 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE