6,7-dimethyl-2-phenylquinoxaline

C16H14N2 — CID 2048

IUPAC6,7-dimethyl-2-phenylquinoxaline
SMILESCc1cc2ncc(-c3ccccc3)nc2cc1C
InChIInChI=1S/C16H14N2/c1-11-8-14-15(9-12(11)2)18-16(10-17-14)13-6-4-3-5-7-13/h3-10H,1-2H3
InChIKeyFQNCLVJEQCJWSU-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.91
Rot. Bonds1

About 6,7-dimethyl-2-phenylquinoxaline

6,7-dimethyl-2-phenylquinoxaline (PubChem CID 2048) has the molecular formula C16H14N2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 6,7-dimethyl-2-phenylquinoxaline.

Molecular Properties

Compound Name6,7-dimethyl-2-phenylquinoxaline
PubChem CID2048
Molecular FormulaC16H14N2
Molecular Weight234.30 g/mol
Exact Mass234.12
IUPAC Name6,7-dimethyl-2-phenylquinoxaline
SMILESCc1cc2ncc(-c3ccccc3)nc2cc1C
InChIInChI=1S/C16H14N2/c1-11-8-14-15(9-12(11)2)18-16(10-17-14)13-6-4-3-5-7-13/h3-10H,1-2H3
InChIKeyFQNCLVJEQCJWSU-UHFFFAOYSA-N
XLogP3.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-2-phenylquinoxaline?
The IUPAC name of 6,7-dimethyl-2-phenylquinoxaline (CID 2048) is 6,7-dimethyl-2-phenylquinoxaline.
What is the SMILES notation for 6,7-dimethyl-2-phenylquinoxaline?
The canonical SMILES for 6,7-dimethyl-2-phenylquinoxaline is Cc1cc2ncc(-c3ccccc3)nc2cc1C.
What is the InChIKey of 6,7-dimethyl-2-phenylquinoxaline?
The InChIKey is FQNCLVJEQCJWSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2/c1-11-8-14-15(9-12(11)2)18-16(10-17-14)13-6-4-3-5-7-13/h3-10H,1-2H3.
What are the key properties of 6,7-dimethyl-2-phenylquinoxaline?
6,7-dimethyl-2-phenylquinoxaline has a molecular weight of 234.30 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-2-phenylquinoxaline is sourced from PubChem (CID 2048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).