2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol

C17H15FN2O — CID 105131294

IUPAC2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol
SMILESCc1cc(F)ccc1CC(O)c1cccc2nccnc12
InChIInChI=1S/C17H15FN2O/c1-11-9-13(18)6-5-12(11)10-16(21)14-3-2-4-15-17(14)20-8-7-19-15/h2-9,16,21H,10H2,1H3
InChIKeyYZFWZDBWUXFBBC-UHFFFAOYSA-N
MW282.32 g/mol
LogP3.35
Rot. Bonds3

About 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol

2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol (PubChem CID 105131294) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol
PubChem CID105131294
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol
SMILESCc1cc(F)ccc1CC(O)c1cccc2nccnc12
InChIInChI=1S/C17H15FN2O/c1-11-9-13(18)6-5-12(11)10-16(21)14-3-2-4-15-17(14)20-8-7-19-15/h2-9,16,21H,10H2,1H3
InChIKeyYZFWZDBWUXFBBC-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

Analyze 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-chloro-4-methylphenyl)-1-quinoxalin-5-ylethanol
CID 106868052
2-(2,4-dichlorophenyl)-1-quinoxalin-5-ylethanol
CID 105086789
2-(2-chloro-3-fluorophenyl)-1-quinoxalin-5-ylethanol
CID 105124141
1-(2-bromophenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346812
2-(4-fluoro-2-methylphenyl)-1-(2-methoxyphenyl)ethanol
CID 114346762
2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol
CID 114347532
1-(3-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346766
4-methylsulfonyl-1-quinoxalin-5-ylbutan-1-ol
CID 105082611
1-(2-bromo-3-methylphenyl)-2-(2,4-difluorophenyl)ethanol
CID 107983845
1-quinoxalin-5-ylbut-3-en-1-ol
CID 105081692
1-(4-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanol
CID 65149639
2-(3-fluorophenyl)-1-quinolin-8-ylethanol
CID 63969349

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol (CID 105131294) is 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol is Cc1cc(F)ccc1CC(O)c1cccc2nccnc12.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol?
The InChIKey is YZFWZDBWUXFBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O/c1-11-9-13(18)6-5-12(11)10-16(21)14-3-2-4-15-17(14)20-8-7-19-15/h2-9,16,21H,10H2,1H3.
What are the key properties of 2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol?
2-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-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-(4-fluoro-2-methylphenyl)-1-quinoxalin-5-ylethanol is sourced from PubChem (CID 105131294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).