5-ethoxy-8-fluoro-1H-quinolin-4-one

C11H10FNO2 — CID 141173306

IUPAC5-ethoxy-8-fluoro-1H-quinolin-4-one
SMILESCCOc1ccc(F)c2[nH]ccc(=O)c12
InChIInChI=1S/C11H10FNO2/c1-2-15-9-4-3-7(12)11-10(9)8(14)5-6-13-11/h3-6H,2H2,1H3,(H,13,14)
InChIKeyJTZIPNHPUGGJPO-UHFFFAOYSA-N
MW207.20 g/mol
LogP2.07
Rot. Bonds2

About 5-ethoxy-8-fluoro-1H-quinolin-4-one

5-ethoxy-8-fluoro-1H-quinolin-4-one (PubChem CID 141173306) has the molecular formula C11H10FNO2 and a molecular weight of 207.20 g/mol. Its IUPAC name is 5-ethoxy-8-fluoro-1H-quinolin-4-one.

Molecular Properties

Compound Name5-ethoxy-8-fluoro-1H-quinolin-4-one
PubChem CID141173306
Molecular FormulaC11H10FNO2
Molecular Weight207.20 g/mol
Exact Mass207.07
IUPAC Name5-ethoxy-8-fluoro-1H-quinolin-4-one
SMILESCCOc1ccc(F)c2[nH]ccc(=O)c12
InChIInChI=1S/C11H10FNO2/c1-2-15-9-4-3-7(12)11-10(9)8(14)5-6-13-11/h3-6H,2H2,1H3,(H,13,14)
InChIKeyJTZIPNHPUGGJPO-UHFFFAOYSA-N
XLogP2.07
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.20
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-8-fluoro-1H-quinolin-4-one?
The IUPAC name of 5-ethoxy-8-fluoro-1H-quinolin-4-one (CID 141173306) is 5-ethoxy-8-fluoro-1H-quinolin-4-one.
What is the SMILES notation for 5-ethoxy-8-fluoro-1H-quinolin-4-one?
The canonical SMILES for 5-ethoxy-8-fluoro-1H-quinolin-4-one is CCOc1ccc(F)c2[nH]ccc(=O)c12.
What is the InChIKey of 5-ethoxy-8-fluoro-1H-quinolin-4-one?
The InChIKey is JTZIPNHPUGGJPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO2/c1-2-15-9-4-3-7(12)11-10(9)8(14)5-6-13-11/h3-6H,2H2,1H3,(H,13,14).
What are the key properties of 5-ethoxy-8-fluoro-1H-quinolin-4-one?
5-ethoxy-8-fluoro-1H-quinolin-4-one has a molecular weight of 207.20 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-8-fluoro-1H-quinolin-4-one is sourced from PubChem (CID 141173306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).