7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one

C15H9ClFNO2 — CID 138382349

IUPAC7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one
SMILESO=c1ccc2ccc(-c3cc(Cl)c(O)cc3F)cc2[nH]1
InChIInChI=1S/C15H9ClFNO2/c16-11-6-10(12(17)7-14(11)19)9-2-1-8-3-4-15(20)18-13(8)5-9/h1-7,19H,(H,18,20)
InChIKeyTWYVYDOIUYWOQB-UHFFFAOYSA-N
MW289.69 g/mol
LogP3.69
Rot. Bonds1

About 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one

7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one (PubChem CID 138382349) has the molecular formula C15H9ClFNO2 and a molecular weight of 289.69 g/mol. Its IUPAC name is 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one.

Molecular Properties

Compound Name7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one
PubChem CID138382349
Molecular FormulaC15H9ClFNO2
Molecular Weight289.69 g/mol
Exact Mass289.03
IUPAC Name7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one
SMILESO=c1ccc2ccc(-c3cc(Cl)c(O)cc3F)cc2[nH]1
InChIInChI=1S/C15H9ClFNO2/c16-11-6-10(12(17)7-14(11)19)9-2-1-8-3-4-15(20)18-13(8)5-9/h1-7,19H,(H,18,20)
InChIKeyTWYVYDOIUYWOQB-UHFFFAOYSA-N
XLogP3.69
TPSA53.09 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.69
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one?
The IUPAC name of 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one (CID 138382349) is 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one.
What is the SMILES notation for 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one?
The canonical SMILES for 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one is O=c1ccc2ccc(-c3cc(Cl)c(O)cc3F)cc2[nH]1.
What is the InChIKey of 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one?
The InChIKey is TWYVYDOIUYWOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClFNO2/c16-11-6-10(12(17)7-14(11)19)9-2-1-8-3-4-15(20)18-13(8)5-9/h1-7,19H,(H,18,20).
What are the key properties of 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one?
7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one has a molecular weight of 289.69 g/mol, XLogP of 3.69, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-chloro-2-fluoro-4-hydroxyphenyl)-1H-quinolin-2-one is sourced from PubChem (CID 138382349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).