8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione

C15H10FNO3 — CID 2786500

IUPAC8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione
SMILESO=C1Nc2c(F)cccc2C(=O)C1(O)c1ccccc1
InChIInChI=1S/C15H10FNO3/c16-11-8-4-7-10-12(11)17-14(19)15(20,13(10)18)9-5-2-1-3-6-9/h1-8,20H,(H,17,19)
InChIKeyINEPABJTKFYZBE-UHFFFAOYSA-N
MW271.25 g/mol
LogP1.85
Rot. Bonds1

About 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione

8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione (PubChem CID 2786500) has the molecular formula C15H10FNO3 and a molecular weight of 271.25 g/mol. Its IUPAC name is 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione.

Molecular Properties

Compound Name8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione
PubChem CID2786500
Molecular FormulaC15H10FNO3
Molecular Weight271.25 g/mol
Exact Mass271.06
IUPAC Name8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione
SMILESO=C1Nc2c(F)cccc2C(=O)C1(O)c1ccccc1
InChIInChI=1S/C15H10FNO3/c16-11-8-4-7-10-12(11)17-14(19)15(20,13(10)18)9-5-2-1-3-6-9/h1-8,20H,(H,17,19)
InChIKeyINEPABJTKFYZBE-UHFFFAOYSA-N
XLogP1.85
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

4,7-dichloro-3-hydroxy-3-phenyl-1H-indol-2-one
CID 102496389
3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one
CID 83036180
3-hydroxy-N,N-dimethyl-2-oxo-3-phenyl-1H-indole-4-carboxamide
CID 102141067
4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one
CID 163232544
3-hydroxy-1-methyl-3-phenylquinoline-2,4-dione
CID 2784777
3-chloro-3-phenyl-1H-quinoline-2,4-dione
CID 2785082
2-hydroxy-2-(4-methylsulfanylphenyl)indene-1,3-dione
CID 71477442
9-fluoro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
CID 138736880
3-hydroxy-1,3-diphenylquinoline-2,4-dione
CID 2784001
8-methoxy-3-nitro-3-phenyl-1H-quinoline-2,4-dione
CID 2793722
6-chloro-3-hydroxy-N,N-dimethyl-2-oxo-3-phenyl-1H-indole-4-carboxamide
CID 132556750
(3R)-3-amino-9-fluoro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
CID 118704781

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione?
The IUPAC name of 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione (CID 2786500) is 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione.
What is the SMILES notation for 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione?
The canonical SMILES for 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione is O=C1Nc2c(F)cccc2C(=O)C1(O)c1ccccc1.
What is the InChIKey of 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione?
The InChIKey is INEPABJTKFYZBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNO3/c16-11-8-4-7-10-12(11)17-14(19)15(20,13(10)18)9-5-2-1-3-6-9/h1-8,20H,(H,17,19).
What are the key properties of 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione?
8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione has a molecular weight of 271.25 g/mol, XLogP of 1.85, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-3-hydroxy-3-phenyl-1H-quinoline-2,4-dione is sourced from PubChem (CID 2786500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).