Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help

A1I9K

Summary
Name:2,5-dimethylpyrazol-3-amine
Formula:C5 H9 N3
Formal charge:0
Formula weight:111.145 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72,5-dimethylpyrazol-3-amine

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C5H9N3/c1-4-3-5(6)8(2)7-4/h3H,6H2,1-2H3
InChIKeyInChI1.06ZFDGMMZLXSFNFU-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cn1nc(C)cc1N
SMILESCACTVS3.385Cn1nc(C)cc1N
SMILES_CANONICALOpenEye OEToolkits2.0.7Cc1cc(n(n1)C)N
SMILESOpenEye OEToolkits2.0.7Cc1cc(n(n1)C)N

254917

PDB entries from 2026-06-10

PDB statisticsPDBj update infoContact PDBjnumon