2,3-dichloro-5,6-dimethylpyrazine

C6H6Cl2N2 — CID 12827800

IUPAC2,3-dichloro-5,6-dimethylpyrazine
SMILESCc1nc(Cl)c(Cl)nc1C
InChIInChI=1S/C6H6Cl2N2/c1-3-4(2)10-6(8)5(7)9-3/h1-2H3
InChIKeyZSOPOANLAMBETK-UHFFFAOYSA-N
MW177.03 g/mol
LogP2.40
Rot. Bonds

About 2,3-dichloro-5,6-dimethylpyrazine

2,3-dichloro-5,6-dimethylpyrazine (PubChem CID 12827800) has the molecular formula C6H6Cl2N2 and a molecular weight of 177.03 g/mol. Its IUPAC name is 2,3-dichloro-5,6-dimethylpyrazine.

Molecular Properties

Compound Name2,3-dichloro-5,6-dimethylpyrazine
PubChem CID12827800
Molecular FormulaC6H6Cl2N2
Molecular Weight177.03 g/mol
Exact Mass175.99
IUPAC Name2,3-dichloro-5,6-dimethylpyrazine
SMILESCc1nc(Cl)c(Cl)nc1C
InChIInChI=1S/C6H6Cl2N2/c1-3-4(2)10-6(8)5(7)9-3/h1-2H3
InChIKeyZSOPOANLAMBETK-UHFFFAOYSA-N
XLogP2.40
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.03
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Tetramethylpyrazine hydrochloride
CID 156709
2-Chloro-3,5,6-trimethylpyrazine
CID 12600392
2,5-Dichloro-3,6-dimethylpyrazine
CID 10877681
2-(Chloromethyl)-3,5,6-trimethylpyrazine
CID 14637615
3-Chloro-5,6-dimethylpyrazine-2-carbonitrile
CID 292147
Hydron;2,3,5,6-tetramethylpyrazine;chloride
CID 45108167
2-Chloro-5,6-dimethyl-3-(trifluoromethyl)pyrazine
CID 84677981
2-Chloro-5-(difluoromethyl)-3,6-dimethylpyrazine
CID 164186499
2,5-Bis(chloromethyl)-3,6-dimethylpyrazine
CID 4101773
2,6-Dichloro-3,5-dimethylpyrazine
CID 10487521
2,3,5-Trichloro-6-methylpyrazine
CID 57775499
2-Chloro-3-methyl-5,6-didehydropyrazine
CID 57861288

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-5,6-dimethylpyrazine?
The IUPAC name of 2,3-dichloro-5,6-dimethylpyrazine (CID 12827800) is 2,3-dichloro-5,6-dimethylpyrazine.
What is the SMILES notation for 2,3-dichloro-5,6-dimethylpyrazine?
The canonical SMILES for 2,3-dichloro-5,6-dimethylpyrazine is Cc1nc(Cl)c(Cl)nc1C.
What is the InChIKey of 2,3-dichloro-5,6-dimethylpyrazine?
The InChIKey is ZSOPOANLAMBETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6Cl2N2/c1-3-4(2)10-6(8)5(7)9-3/h1-2H3.
What are the key properties of 2,3-dichloro-5,6-dimethylpyrazine?
2,3-dichloro-5,6-dimethylpyrazine has a molecular weight of 177.03 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-5,6-dimethylpyrazine is sourced from PubChem (CID 12827800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).