2-(2-methoxyphenyl)-3-phenylquinoxaline

C21H16N2O — CID 805925

IUPAC2-(2-methoxyphenyl)-3-phenylquinoxaline
SMILESCOc1ccccc1-c1nc2ccccc2nc1-c1ccccc1
InChIInChI=1S/C21H16N2O/c1-24-19-14-8-5-11-16(19)21-20(15-9-3-2-4-10-15)22-17-12-6-7-13-18(17)23-21/h2-14H,1H3
InChIKeyGRHHTAWTWPMOCU-UHFFFAOYSA-N
MW312.37 g/mol
LogP4.97
Rot. Bonds3

About 2-(2-methoxyphenyl)-3-phenylquinoxaline

2-(2-methoxyphenyl)-3-phenylquinoxaline (PubChem CID 805925) has the molecular formula C21H16N2O and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-3-phenylquinoxaline.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-3-phenylquinoxaline
PubChem CID805925
Molecular FormulaC21H16N2O
Molecular Weight312.37 g/mol
Exact Mass312.13
IUPAC Name2-(2-methoxyphenyl)-3-phenylquinoxaline
SMILESCOc1ccccc1-c1nc2ccccc2nc1-c1ccccc1
InChIInChI=1S/C21H16N2O/c1-24-19-14-8-5-11-16(19)21-20(15-9-3-2-4-10-15)22-17-12-6-7-13-18(17)23-21/h2-14H,1H3
InChIKeyGRHHTAWTWPMOCU-UHFFFAOYSA-N
XLogP4.97
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-3-phenylquinoxaline?
The IUPAC name of 2-(2-methoxyphenyl)-3-phenylquinoxaline (CID 805925) is 2-(2-methoxyphenyl)-3-phenylquinoxaline.
What is the SMILES notation for 2-(2-methoxyphenyl)-3-phenylquinoxaline?
The canonical SMILES for 2-(2-methoxyphenyl)-3-phenylquinoxaline is COc1ccccc1-c1nc2ccccc2nc1-c1ccccc1.
What is the InChIKey of 2-(2-methoxyphenyl)-3-phenylquinoxaline?
The InChIKey is GRHHTAWTWPMOCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O/c1-24-19-14-8-5-11-16(19)21-20(15-9-3-2-4-10-15)22-17-12-6-7-13-18(17)23-21/h2-14H,1H3.
What are the key properties of 2-(2-methoxyphenyl)-3-phenylquinoxaline?
2-(2-methoxyphenyl)-3-phenylquinoxaline has a molecular weight of 312.37 g/mol, XLogP of 4.97, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-3-phenylquinoxaline is sourced from PubChem (CID 805925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).