1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone

C11H8FNO2 — CID 59634613

IUPAC1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone
SMILESCC(=O)c1nc2ccc(F)cc2cc1O
InChIInChI=1S/C11H8FNO2/c1-6(14)11-10(15)5-7-4-8(12)2-3-9(7)13-11/h2-5,15H,1H3
InChIKeyVILNLKNEGIFREW-UHFFFAOYSA-N
MW205.19 g/mol
LogP2.28
Rot. Bonds1

About 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone

1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone (PubChem CID 59634613) has the molecular formula C11H8FNO2 and a molecular weight of 205.19 g/mol. Its IUPAC name is 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone.

Molecular Properties

Compound Name1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone
PubChem CID59634613
Molecular FormulaC11H8FNO2
Molecular Weight205.19 g/mol
Exact Mass205.05
IUPAC Name1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone
SMILESCC(=O)c1nc2ccc(F)cc2cc1O
InChIInChI=1S/C11H8FNO2/c1-6(14)11-10(15)5-7-4-8(12)2-3-9(7)13-11/h2-5,15H,1H3
InChIKeyVILNLKNEGIFREW-UHFFFAOYSA-N
XLogP2.28
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone?
The IUPAC name of 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone (CID 59634613) is 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone.
What is the SMILES notation for 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone?
The canonical SMILES for 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone is CC(=O)c1nc2ccc(F)cc2cc1O.
What is the InChIKey of 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone?
The InChIKey is VILNLKNEGIFREW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FNO2/c1-6(14)11-10(15)5-7-4-8(12)2-3-9(7)13-11/h2-5,15H,1H3.
What are the key properties of 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone?
1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone has a molecular weight of 205.19 g/mol, XLogP of 2.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-3-hydroxyquinolin-2-yl)ethanone is sourced from PubChem (CID 59634613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).