2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol

C16H13FN2O — CID 107357548

IUPAC2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol
SMILESOC(Cc1cccc(F)c1)c1cnc2ccccc2n1
InChIInChI=1S/C16H13FN2O/c17-12-5-3-4-11(8-12)9-16(20)15-10-18-13-6-1-2-7-14(13)19-15/h1-8,10,16,20H,9H2
InChIKeyPYBYDOSJNALVLD-UHFFFAOYSA-N
MW268.29 g/mol
LogP3.05
Rot. Bonds3

About 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol

2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol (PubChem CID 107357548) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol
PubChem CID107357548
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC Name2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol
SMILESOC(Cc1cccc(F)c1)c1cnc2ccccc2n1
InChIInChI=1S/C16H13FN2O/c17-12-5-3-4-11(8-12)9-16(20)15-10-18-13-6-1-2-7-14(13)19-15/h1-8,10,16,20H,9H2
InChIKeyPYBYDOSJNALVLD-UHFFFAOYSA-N
XLogP3.05
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 53.05
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-(5-fluoro-2-methylphenyl)-1-quinoxalin-2-ylethanol
CID 107357762
1-quinoxalin-2-ylbut-3-yn-1-ol
CID 86630247
2-(3-bromo-5-fluorophenyl)-1-quinoxalin-2-ylethanamine
CID 107357326
2-(3-fluorophenyl)-1-(2,4,5-trifluorophenyl)ethanol
CID 103303315
2-(3-fluorophenyl)-1-quinolin-8-ylethanol
CID 63969349
2-phenyl-1-quinoxalin-2-ylethanamine
CID 107356898
1-(5-chloro-1,3-thiazol-2-yl)-2-(3-fluorophenyl)ethanol
CID 107125030
2-(2-bromo-5-fluorophenyl)-1-quinoxalin-2-ylethanamine
CID 107357047
1-(3-fluorophenyl)-3-naphthalen-2-ylpropan-2-ol
CID 105079027
N-[6-amino-1-(3-fluorophenyl)-6-oxohexan-2-yl]quinoxaline-2-carboxamide;2-methylbutan-2-ol
CID 143143492
1-(2-chloro-4,5-difluorophenyl)-2-(3-fluorophenyl)ethanol
CID 107477080

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol?
The IUPAC name of 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol (CID 107357548) is 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol.
What is the SMILES notation for 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol?
The canonical SMILES for 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol is OC(Cc1cccc(F)c1)c1cnc2ccccc2n1.
What is the InChIKey of 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol?
The InChIKey is PYBYDOSJNALVLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c17-12-5-3-4-11(8-12)9-16(20)15-10-18-13-6-1-2-7-14(13)19-15/h1-8,10,16,20H,9H2.
What are the key properties of 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol?
2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol has a molecular weight of 268.29 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-quinoxalin-2-ylethanol is sourced from PubChem (CID 107357548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).