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

L30

Summary
Name:N-(naphthalen-1-yl)pyridine-3-carboxamide
Formula:C16 H12 N2 O
Formal charge:0
Formula weight:248.279 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N-(naphthalen-1-yl)pyridine-3-carboxamide
OpenEye OEToolkits2.0.7~{N}-naphthalen-1-ylpyridine-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(Nc1cccc2ccccc21)c1cccnc1
InChIInChI1.03InChI=1S/C16H12N2O/c19-16(13-7-4-10-17-11-13)18-15-9-3-6-12-5-1-2-8-14(12)15/h1-11H,(H,18,19)
InChIKeyInChI1.03OZOFJVFWGZHBHV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385O=C(Nc1cccc2ccccc12)c3cccnc3
SMILESCACTVS3.385O=C(Nc1cccc2ccccc12)c3cccnc3
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc2c(c1)cccc2NC(=O)c3cccnc3
SMILESOpenEye OEToolkits2.0.7c1ccc2c(c1)cccc2NC(=O)c3cccnc3

218853

PDB entries from 2024-04-24

PDB statisticsPDBj update infoContact PDBjnumon