2-(4-chlorophenyl)-3-methylpyrazine

C11H9ClN2 — CID 90168238

IUPAC2-(4-chlorophenyl)-3-methylpyrazine
SMILESCc1nccnc1-c1ccc(Cl)cc1
InChIInChI=1S/C11H9ClN2/c1-8-11(14-7-6-13-8)9-2-4-10(12)5-3-9/h2-7H,1H3
InChIKeyAZWAZGGEZHOXDJ-UHFFFAOYSA-N
MW204.66 g/mol
LogP3.11
Rot. Bonds1

About 2-(4-chlorophenyl)-3-methylpyrazine

2-(4-chlorophenyl)-3-methylpyrazine (PubChem CID 90168238) has the molecular formula C11H9ClN2 and a molecular weight of 204.66 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-methylpyrazine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-methylpyrazine
PubChem CID90168238
Molecular FormulaC11H9ClN2
Molecular Weight204.66 g/mol
Exact Mass204.05
IUPAC Name2-(4-chlorophenyl)-3-methylpyrazine
SMILESCc1nccnc1-c1ccc(Cl)cc1
InChIInChI=1S/C11H9ClN2/c1-8-11(14-7-6-13-8)9-2-4-10(12)5-3-9/h2-7H,1H3
InChIKeyAZWAZGGEZHOXDJ-UHFFFAOYSA-N
XLogP3.11
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.66
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(4-chlorophenyl)pyrazin-2-yl]hydrazine
CID 13199872
2-(4-chlorophenyl)-3-fluoropyridine
CID 66678603
2-(4-chlorophenyl)-3-methoxypyridine
CID 90122541
2-(4-chlorophenyl)-3-methylsulfanylpyridine
CID 19850805
2,3-bis(4-chlorophenyl)-5-methylpyrazine
CID 14096510
2-[3-(4-chlorophenyl)pyrazin-2-yl]propanoic acid
CID 21413155
2-(4-chlorophenyl)-3-methylsulfanylpyridine;hydrochloride
CID 19850804
7-[3-(4-chlorophenyl)phenyl]-6-methylpyrido[2,3-b]pyrazine
CID 167985419
5-(4-chlorophenyl)-2,4,6-trimethylpyrimidine
CID 13046106
2-(4-chlorophenyl)-3-(methoxymethyl)pyridine
CID 59165700
2,5-dibromo-3-(4-chlorophenyl)pyrazine
CID 86616976
1-chloro-4-methylbenzene;zinc
CID 174694335

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-methylpyrazine?
The IUPAC name of 2-(4-chlorophenyl)-3-methylpyrazine (CID 90168238) is 2-(4-chlorophenyl)-3-methylpyrazine.
What is the SMILES notation for 2-(4-chlorophenyl)-3-methylpyrazine?
The canonical SMILES for 2-(4-chlorophenyl)-3-methylpyrazine is Cc1nccnc1-c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-3-methylpyrazine?
The InChIKey is AZWAZGGEZHOXDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2/c1-8-11(14-7-6-13-8)9-2-4-10(12)5-3-9/h2-7H,1H3.
What are the key properties of 2-(4-chlorophenyl)-3-methylpyrazine?
2-(4-chlorophenyl)-3-methylpyrazine has a molecular weight of 204.66 g/mol, XLogP of 3.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-methylpyrazine is sourced from PubChem (CID 90168238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).