26D

PYRIDINE-2,6-DIAMINE

Created: 2005-08-23
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count15
Chiral Atom Count0
Bond Count15
Aromatic Bond Count6
2D diagram of 26D

Chemical Component Summary

NamePYRIDINE-2,6-DIAMINE
Systematic Name (OpenEye OEToolkits)pyridine-2,6-diamine
FormulaC5 H7 N3
Molecular Weight109.129
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04n1c(N)cccc1N
SMILESCACTVS3.341Nc1cccc(N)n1
SMILESOpenEye OEToolkits1.5.0c1cc(nc(c1)N)N
Canonical SMILESCACTVS3.341 Nc1cccc(N)n1
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc(nc(c1)N)N
InChIInChI1.03 InChI=1S/C5H7N3/c6-4-2-1-3-5(7)8-4/h1-3H,(H4,6,7,8)
InChIKeyInChI1.03 VHNQIURBCCNWDN-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 8861
ChEMBL CHEMBL339234
CCDC/CSD DEDMEH, ASESIC, DEDMAD, FOYLEK01, FOYLEK
COD 2020898