2-(2,3-dichlorophenyl)-6-methoxypyrazine

C11H8Cl2N2O — CID 160525380

IUPAC2-(2,3-dichlorophenyl)-6-methoxypyrazine
SMILESCOc1cncc(-c2cccc(Cl)c2Cl)n1
InChIInChI=1S/C11H8Cl2N2O/c1-16-10-6-14-5-9(15-10)7-3-2-4-8(12)11(7)13/h2-6H,1H3
InChIKeyOHFZVGAVCFGQCY-UHFFFAOYSA-N
MW255.10 g/mol
LogP3.46
Rot. Bonds2

About 2-(2,3-dichlorophenyl)-6-methoxypyrazine

2-(2,3-dichlorophenyl)-6-methoxypyrazine (PubChem CID 160525380) has the molecular formula C11H8Cl2N2O and a molecular weight of 255.10 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-6-methoxypyrazine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-6-methoxypyrazine
PubChem CID160525380
Molecular FormulaC11H8Cl2N2O
Molecular Weight255.10 g/mol
Exact Mass254.00
IUPAC Name2-(2,3-dichlorophenyl)-6-methoxypyrazine
SMILESCOc1cncc(-c2cccc(Cl)c2Cl)n1
InChIInChI=1S/C11H8Cl2N2O/c1-16-10-6-14-5-9(15-10)7-3-2-4-8(12)11(7)13/h2-6H,1H3
InChIKeyOHFZVGAVCFGQCY-UHFFFAOYSA-N
XLogP3.46
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.10
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-6-methoxypyrazine?
The IUPAC name of 2-(2,3-dichlorophenyl)-6-methoxypyrazine (CID 160525380) is 2-(2,3-dichlorophenyl)-6-methoxypyrazine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-6-methoxypyrazine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-6-methoxypyrazine is COc1cncc(-c2cccc(Cl)c2Cl)n1.
What is the InChIKey of 2-(2,3-dichlorophenyl)-6-methoxypyrazine?
The InChIKey is OHFZVGAVCFGQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O/c1-16-10-6-14-5-9(15-10)7-3-2-4-8(12)11(7)13/h2-6H,1H3.
What are the key properties of 2-(2,3-dichlorophenyl)-6-methoxypyrazine?
2-(2,3-dichlorophenyl)-6-methoxypyrazine has a molecular weight of 255.10 g/mol, XLogP of 3.46, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-6-methoxypyrazine is sourced from PubChem (CID 160525380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).