GJG

6-(cyclohexylamino)pyridine-3-carboxamide

Created:2018-05-23
Last modified:  2018-10-17

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Chemical Details

Formal Charge0
Atom Count33
Chiral Atom Count0
Bond Count34
Aromatic Bond Count6
2D diagram of GJG

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Chemical Component Summary

Name6-(cyclohexylamino)pyridine-3-carboxamide
Systematic Name (OpenEye OEToolkits)6-(cyclohexylamino)pyridine-3-carboxamide
FormulaC12 H17 N3 O
Molecular Weight219.283
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n1cc(ccc1NC2CCCCC2)C(=O)N
SMILESCACTVS3.385NC(=O)c1ccc(NC2CCCCC2)nc1
SMILESOpenEye OEToolkits2.0.6c1cc(ncc1C(=O)N)NC2CCCCC2
Canonical SMILESCACTVS3.385 NC(=O)c1ccc(NC2CCCCC2)nc1
Canonical SMILESOpenEye OEToolkits2.0.6 c1cc(ncc1C(=O)N)NC2CCCCC2
InChIInChI1.03 InChI=1S/C12H17N3O/c13-12(16)9-6-7-11(14-8-9)15-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H2,13,16)(H,14,15)
InChIKeyInChI1.03 DGZXVZSOZVPFDW-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 3031415
ChEMBL CHEMBL4279288