3-methyl-4-quinoxalin-2-ylphenol

C15H12N2O — CID 659650

IUPAC3-methyl-4-quinoxalin-2-ylphenol
SMILESCc1cc(O)ccc1-c1cnc2ccccc2n1
InChIInChI=1S/C15H12N2O/c1-10-8-11(18)6-7-12(10)15-9-16-13-4-2-3-5-14(13)17-15/h2-9,18H,1H3
InChIKeyZJZZYSKZHPOANN-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.31
Rot. Bonds1

About 3-methyl-4-quinoxalin-2-ylphenol

3-methyl-4-quinoxalin-2-ylphenol (PubChem CID 659650) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 3-methyl-4-quinoxalin-2-ylphenol.

Molecular Properties

Compound Name3-methyl-4-quinoxalin-2-ylphenol
PubChem CID659650
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name3-methyl-4-quinoxalin-2-ylphenol
SMILESCc1cc(O)ccc1-c1cnc2ccccc2n1
InChIInChI=1S/C15H12N2O/c1-10-8-11(18)6-7-12(10)15-9-16-13-4-2-3-5-14(13)17-15/h2-9,18H,1H3
InChIKeyZJZZYSKZHPOANN-UHFFFAOYSA-N
XLogP3.31
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-quinoxalin-2-ylphenol?
The IUPAC name of 3-methyl-4-quinoxalin-2-ylphenol (CID 659650) is 3-methyl-4-quinoxalin-2-ylphenol.
What is the SMILES notation for 3-methyl-4-quinoxalin-2-ylphenol?
The canonical SMILES for 3-methyl-4-quinoxalin-2-ylphenol is Cc1cc(O)ccc1-c1cnc2ccccc2n1.
What is the InChIKey of 3-methyl-4-quinoxalin-2-ylphenol?
The InChIKey is ZJZZYSKZHPOANN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-10-8-11(18)6-7-12(10)15-9-16-13-4-2-3-5-14(13)17-15/h2-9,18H,1H3.
What are the key properties of 3-methyl-4-quinoxalin-2-ylphenol?
3-methyl-4-quinoxalin-2-ylphenol has a molecular weight of 236.27 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-quinoxalin-2-ylphenol is sourced from PubChem (CID 659650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).