Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

UAW

Summary
Name:~{N}-(4-hydroxyphenyl)-4-methyl-piperidine-1-carboxamide
Formula:C13 H18 N2 O2
Formal charge:0
Formula weight:234.294 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-(4-hydroxyphenyl)-4-methyl-piperidine-1-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C13H18N2O2/c1-10-6-8-15(9-7-10)13(17)14-11-2-4-12(16)5-3-11/h2-5,10,16H,6-9H2,1H3,(H,14,17)
InChIKeyInChI1.03UZAHGCAHTQUCTG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC1CCN(CC1)C(=O)Nc2ccc(O)cc2
SMILESCACTVS3.385CC1CCN(CC1)C(=O)Nc2ccc(O)cc2
SMILES_CANONICALOpenEye OEToolkits2.0.7CC1CCN(CC1)C(=O)Nc2ccc(cc2)O
SMILESOpenEye OEToolkits2.0.7CC1CCN(CC1)C(=O)Nc2ccc(cc2)O

222415

PDB entries from 2024-07-10

PDB statisticsPDBj update infoContact PDBjnumon