25R

2,5-dimethylpyrazine

Created:2009-11-06
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count16
Chiral Atom Count0
Bond Count16
Aromatic Bond Count6
2D diagram of 25R

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Chemical Component Summary

Name2,5-dimethylpyrazine
Systematic Name (OpenEye OEToolkits)2,5-dimethylpyrazine
FormulaC6 H8 N2
Molecular Weight108.141
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.352Cc1cnc(C)cn1
SMILESOpenEye OEToolkits1.7.0Cc1cnc(cn1)C
Canonical SMILESCACTVS3.352 Cc1cnc(C)cn1
Canonical SMILESOpenEye OEToolkits1.7.0 Cc1cnc(cn1)C
InChIInChI1.03 InChI=1S/C6H8N2/c1-5-3-8-6(2)4-7-5/h3-4H,1-2H3
InChIKeyInChI1.03 LCZUOKDVTBMCMX-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 31252
ChEMBL CHEMBL94709
ChEBI CHEBI:89762
CCDC/CSD BAWZOR, CUTDOM, BAWZIL, BAXBAG, JADVAO, JUJFAV, LOSHOS, JOJXEO, GIFFEJ, KAHBAZ, BIZZAO
COD 7224174, 7051298