6-methyl-2,3-bis(4-methylphenyl)quinoxaline

C23H20N2 — CID 5001967

IUPAC6-methyl-2,3-bis(4-methylphenyl)quinoxaline
SMILESCc1ccc(-c2nc3ccc(C)cc3nc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C23H20N2/c1-15-4-9-18(10-5-15)22-23(19-11-6-16(2)7-12-19)25-21-14-17(3)8-13-20(21)24-22/h4-14H,1-3H3
InChIKeyMVANDNULMPIFQE-UHFFFAOYSA-N
MW324.43 g/mol
LogP5.89
Rot. Bonds2

About 6-methyl-2,3-bis(4-methylphenyl)quinoxaline

6-methyl-2,3-bis(4-methylphenyl)quinoxaline (PubChem CID 5001967) has the molecular formula C23H20N2 and a molecular weight of 324.43 g/mol. Its IUPAC name is 6-methyl-2,3-bis(4-methylphenyl)quinoxaline.

Molecular Properties

Compound Name6-methyl-2,3-bis(4-methylphenyl)quinoxaline
PubChem CID5001967
Molecular FormulaC23H20N2
Molecular Weight324.43 g/mol
Exact Mass324.16
IUPAC Name6-methyl-2,3-bis(4-methylphenyl)quinoxaline
SMILESCc1ccc(-c2nc3ccc(C)cc3nc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C23H20N2/c1-15-4-9-18(10-5-15)22-23(19-11-6-16(2)7-12-19)25-21-14-17(3)8-13-20(21)24-22/h4-14H,1-3H3
InChIKeyMVANDNULMPIFQE-UHFFFAOYSA-N
XLogP5.89
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.43
LogP ≤ 55.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2,3-bis(4-methylphenyl)quinoxaline?
The IUPAC name of 6-methyl-2,3-bis(4-methylphenyl)quinoxaline (CID 5001967) is 6-methyl-2,3-bis(4-methylphenyl)quinoxaline.
What is the SMILES notation for 6-methyl-2,3-bis(4-methylphenyl)quinoxaline?
The canonical SMILES for 6-methyl-2,3-bis(4-methylphenyl)quinoxaline is Cc1ccc(-c2nc3ccc(C)cc3nc2-c2ccc(C)cc2)cc1.
What is the InChIKey of 6-methyl-2,3-bis(4-methylphenyl)quinoxaline?
The InChIKey is MVANDNULMPIFQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2/c1-15-4-9-18(10-5-15)22-23(19-11-6-16(2)7-12-19)25-21-14-17(3)8-13-20(21)24-22/h4-14H,1-3H3.
What are the key properties of 6-methyl-2,3-bis(4-methylphenyl)quinoxaline?
6-methyl-2,3-bis(4-methylphenyl)quinoxaline has a molecular weight of 324.43 g/mol, XLogP of 5.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2,3-bis(4-methylphenyl)quinoxaline is sourced from PubChem (CID 5001967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).