2-(3-phenylquinoxalin-2-yl)phenol

C20H14N2O — CID 2065030

IUPAC2-(3-phenylquinoxalin-2-yl)phenol
SMILESOc1ccccc1-c1nc2ccccc2nc1-c1ccccc1
InChIInChI=1S/C20H14N2O/c23-18-13-7-4-10-15(18)20-19(14-8-2-1-3-9-14)21-16-11-5-6-12-17(16)22-20/h1-13,23H
InChIKeyWYAVXXXJEGLNFR-UHFFFAOYSA-N
MW298.35 g/mol
LogP4.67
Rot. Bonds2

About 2-(3-phenylquinoxalin-2-yl)phenol

2-(3-phenylquinoxalin-2-yl)phenol (PubChem CID 2065030) has the molecular formula C20H14N2O and a molecular weight of 298.35 g/mol. Its IUPAC name is 2-(3-phenylquinoxalin-2-yl)phenol.

Molecular Properties

Compound Name2-(3-phenylquinoxalin-2-yl)phenol
PubChem CID2065030
Molecular FormulaC20H14N2O
Molecular Weight298.35 g/mol
Exact Mass298.11
IUPAC Name2-(3-phenylquinoxalin-2-yl)phenol
SMILESOc1ccccc1-c1nc2ccccc2nc1-c1ccccc1
InChIInChI=1S/C20H14N2O/c23-18-13-7-4-10-15(18)20-19(14-8-2-1-3-9-14)21-16-11-5-6-12-17(16)22-20/h1-13,23H
InChIKeyWYAVXXXJEGLNFR-UHFFFAOYSA-N
XLogP4.67
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_66_E(1)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-phenylquinoxalin-2-yl)phenol?
The IUPAC name of 2-(3-phenylquinoxalin-2-yl)phenol (CID 2065030) is 2-(3-phenylquinoxalin-2-yl)phenol.
What is the SMILES notation for 2-(3-phenylquinoxalin-2-yl)phenol?
The canonical SMILES for 2-(3-phenylquinoxalin-2-yl)phenol is Oc1ccccc1-c1nc2ccccc2nc1-c1ccccc1.
What is the InChIKey of 2-(3-phenylquinoxalin-2-yl)phenol?
The InChIKey is WYAVXXXJEGLNFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O/c23-18-13-7-4-10-15(18)20-19(14-8-2-1-3-9-14)21-16-11-5-6-12-17(16)22-20/h1-13,23H.
What are the key properties of 2-(3-phenylquinoxalin-2-yl)phenol?
2-(3-phenylquinoxalin-2-yl)phenol has a molecular weight of 298.35 g/mol, XLogP of 4.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-phenylquinoxalin-2-yl)phenol is sourced from PubChem (CID 2065030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).