2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine

C18H16N2 — CID 134354488

IUPAC2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine
SMILESCc1ccccc1-c1cccc(-c2cnccn2)c1C
InChIInChI=1S/C18H16N2/c1-13-6-3-4-7-15(13)16-8-5-9-17(14(16)2)18-12-19-10-11-20-18/h3-12H,1-2H3
InChIKeyODLYUFCBWFXRJA-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.43
Rot. Bonds2

About 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine

2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine (PubChem CID 134354488) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine.

Molecular Properties

Compound Name2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine
PubChem CID134354488
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine
SMILESCc1ccccc1-c1cccc(-c2cnccn2)c1C
InChIInChI=1S/C18H16N2/c1-13-6-3-4-7-15(13)16-8-5-9-17(14(16)2)18-12-19-10-11-20-18/h3-12H,1-2H3
InChIKeyODLYUFCBWFXRJA-UHFFFAOYSA-N
XLogP4.43
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine?
The IUPAC name of 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine (CID 134354488) is 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine.
What is the SMILES notation for 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine?
The canonical SMILES for 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine is Cc1ccccc1-c1cccc(-c2cnccn2)c1C.
What is the InChIKey of 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine?
The InChIKey is ODLYUFCBWFXRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c1-13-6-3-4-7-15(13)16-8-5-9-17(14(16)2)18-12-19-10-11-20-18/h3-12H,1-2H3.
What are the key properties of 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine?
2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine has a molecular weight of 260.34 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine is sourced from PubChem (CID 134354488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).