4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione

C10H8FNO3 — CID 68641443

IUPAC4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione
SMILESCC1=c2c(F)c(O)c(=O)[nH]c2=CCC1=O
InChIInChI=1S/C10H8FNO3/c1-4-6(13)3-2-5-7(4)8(11)9(14)10(15)12-5/h2,14H,3H2,1H3,(H,12,15)
InChIKeyXLKNNQQTSPBUJZ-UHFFFAOYSA-N
MW209.18 g/mol
LogP-0.86
Rot. Bonds

About 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione

4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione (PubChem CID 68641443) has the molecular formula C10H8FNO3 and a molecular weight of 209.18 g/mol. Its IUPAC name is 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione.

Molecular Properties

Compound Name4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione
PubChem CID68641443
Molecular FormulaC10H8FNO3
Molecular Weight209.18 g/mol
Exact Mass209.05
IUPAC Name4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione
SMILESCC1=c2c(F)c(O)c(=O)[nH]c2=CCC1=O
InChIInChI=1S/C10H8FNO3/c1-4-6(13)3-2-5-7(4)8(11)9(14)10(15)12-5/h2,14H,3H2,1H3,(H,12,15)
InChIKeyXLKNNQQTSPBUJZ-UHFFFAOYSA-N
XLogP-0.86
TPSA70.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.18
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione?
The IUPAC name of 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione (CID 68641443) is 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione.
What is the SMILES notation for 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione?
The canonical SMILES for 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione is CC1=c2c(F)c(O)c(=O)[nH]c2=CCC1=O.
What is the InChIKey of 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione?
The InChIKey is XLKNNQQTSPBUJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO3/c1-4-6(13)3-2-5-7(4)8(11)9(14)10(15)12-5/h2,14H,3H2,1H3,(H,12,15).
What are the key properties of 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione?
4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione has a molecular weight of 209.18 g/mol, XLogP of -0.86, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-hydroxy-5-methyl-1,7-dihydroquinoline-2,6-dione is sourced from PubChem (CID 68641443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).