4-quinoxalin-2-ylphenol

C14H10N2O — CID 787366

IUPAC4-quinoxalin-2-ylphenol
SMILESOc1ccc(-c2cnc3ccccc3n2)cc1
InChIInChI=1S/C14H10N2O/c17-11-7-5-10(6-8-11)14-9-15-12-3-1-2-4-13(12)16-14/h1-9,17H
InChIKeyQGECDAQWBBZAAZ-UHFFFAOYSA-N
MW222.25 g/mol
LogP3.00
Rot. Bonds1

About 4-quinoxalin-2-ylphenol

4-quinoxalin-2-ylphenol (PubChem CID 787366) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is 4-quinoxalin-2-ylphenol.

Molecular Properties

Compound Name4-quinoxalin-2-ylphenol
PubChem CID787366
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name4-quinoxalin-2-ylphenol
SMILESOc1ccc(-c2cnc3ccccc3n2)cc1
InChIInChI=1S/C14H10N2O/c17-11-7-5-10(6-8-11)14-9-15-12-3-1-2-4-13(12)16-14/h1-9,17H
InChIKeyQGECDAQWBBZAAZ-UHFFFAOYSA-N
XLogP3.00
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
7-Hydroxyquinoline
CID 135426866
Quinolin-5-ol
CID 135441757
8-Aminoquinolin-6-ol
CID 244284
4-(4-Hydroxy-3-methylphenyl)quinolin-7-ol
CID 135567366
6-Quinoxalinol
CID 135420609
4-(6,7-Dimethylquinoxalin-2-yl)benzene-1,2-diol
CID 2050
3-[5-(3-Hydroxyphenyl)pyrazin-2-yl]phenol
CID 25093399
2-(4-Ethoxyphenyl)quinoxaline
CID 765189
2-[(Quinolin-8-ylamino)methyl]phenol
CID 890662
2-(3-Phenylquinoxalin-2-yl)phenol
CID 2065030
Phenol, p-[2-(4-quinolyl)vinyl]-
CID 741423

Frequently Asked Questions

What is the IUPAC name of 4-quinoxalin-2-ylphenol?
The IUPAC name of 4-quinoxalin-2-ylphenol (CID 787366) is 4-quinoxalin-2-ylphenol.
What is the SMILES notation for 4-quinoxalin-2-ylphenol?
The canonical SMILES for 4-quinoxalin-2-ylphenol is Oc1ccc(-c2cnc3ccccc3n2)cc1.
What is the InChIKey of 4-quinoxalin-2-ylphenol?
The InChIKey is QGECDAQWBBZAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O/c17-11-7-5-10(6-8-11)14-9-15-12-3-1-2-4-13(12)16-14/h1-9,17H.
What are the key properties of 4-quinoxalin-2-ylphenol?
4-quinoxalin-2-ylphenol has a molecular weight of 222.25 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-quinoxalin-2-ylphenol is sourced from PubChem (CID 787366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).