2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol

C17H15FN2O — CID 107357762

IUPAC2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol
SMILESCc1ccc(F)cc1CC(O)c1cnc2ccccc2n1
InChIInChI=1S/C17H15FN2O/c1-11-6-7-13(18)8-12(11)9-17(21)16-10-19-14-4-2-3-5-15(14)20-16/h2-8,10,17,21H,9H2,1H3
InChIKeyIZFRSBKRNATTAT-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.35
Rot. Bonds3

About 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol

2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol (PubChem CID 107357762) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol.

Molecular Properties

Compound Name2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol
PubChem CID107357762
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol
SMILESCc1ccc(F)cc1CC(O)c1cnc2ccccc2n1
InChIInChI=1S/C17H15FN2O/c1-11-6-7-13(18)8-12(11)9-17(21)16-10-19-14-4-2-3-5-15(14)20-16/h2-8,10,17,21H,9H2,1H3
InChIKeyIZFRSBKRNATTAT-UHFFFAOYSA-N
XLogP3.35
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromo-4-fluorophenyl)-1-quinoxalin-2-ylethanol
CID 107357592
2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol
CID 107357548
1-(5-chloro-2-pyridinyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105373532
2-(3-chloro-2-fluorophenyl)-1-quinoxalin-2-ylethanol
CID 107357768
1-(2,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372816
2-(5-fluoro-2-methylphenyl)-1-(6-methoxypyrimidin-4-yl)ethanol
CID 102950239
2-(2-fluorophenyl)-1-(4-methylquinolin-2-yl)ethanol
CID 114754909
(4-fluoro-2-methylphenyl)-quinoxalin-2-ylmethanamine
CID 107357093
2-(2-bromo-5-fluorophenyl)-1-quinoxalin-2-ylethanamine
CID 107357047
2-(5-fluoro-2-methylphenyl)-1-(2-iodophenyl)ethanol
CID 105377699
1-(3,4-difluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372805
1-(4-tert-butylphenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105372779

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol?
The IUPAC name of 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol (CID 107357762) is 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol.
What is the SMILES notation for 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol?
The canonical SMILES for 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol is Cc1ccc(F)cc1CC(O)c1cnc2ccccc2n1.
What is the InChIKey of 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol?
The InChIKey is IZFRSBKRNATTAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-11-6-7-13(18)8-12(11)9-17(21)16-10-19-14-4-2-3-5-15(14)20-16/h2-8,10,17,21H,9H2,1H3.
What are the key properties of 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol?
2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol has a molecular weight of 282.32 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol is sourced from PubChem (CID 107357762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).