7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one

C15H9ClFNO2 — CID 54717754

IUPAC7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccc(F)cc1
InChIInChI=1S/C15H9ClFNO2/c16-9-3-6-11-12(7-9)18-15(20)13(14(11)19)8-1-4-10(17)5-2-8/h1-7H,(H2,18,19,20)
InChIKeyMWZSIFMUSUHYIQ-UHFFFAOYSA-N
MW289.69 g/mol
LogP3.69
Rot. Bonds1

About 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one

7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one (PubChem CID 54717754) has the molecular formula C15H9ClFNO2 and a molecular weight of 289.69 g/mol. Its IUPAC name is 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one
PubChem CID54717754
Molecular FormulaC15H9ClFNO2
Molecular Weight289.69 g/mol
Exact Mass289.03
IUPAC Name7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccc(F)cc1
InChIInChI=1S/C15H9ClFNO2/c16-9-3-6-11-12(7-9)18-15(20)13(14(11)19)8-1-4-10(17)5-2-8/h1-7H,(H2,18,19,20)
InChIKeyMWZSIFMUSUHYIQ-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-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one?
The IUPAC name of 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one (CID 54717754) is 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one is O=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccc(F)cc1.
What is the InChIKey of 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one?
The InChIKey is MWZSIFMUSUHYIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClFNO2/c16-9-3-6-11-12(7-9)18-15(20)13(14(11)19)8-1-4-10(17)5-2-8/h1-7H,(H2,18,19,20).
What are the key properties of 7-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one?
7-chloro-3-(4-fluorophenyl)-4-hydroxy-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-chloro-3-(4-fluorophenyl)-4-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 54717754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).