4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one

C8H4F2N2O2 — CID 46211865

IUPAC4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one
SMILESO=c1[nH]c2nccc(F)c2c(F)c1O
InChIInChI=1S/C8H4F2N2O2/c9-3-1-2-11-7-4(3)5(10)6(13)8(14)12-7/h1-2,13H,(H,11,12,14)
InChIKeyPQGWRZUYRFCHQD-UHFFFAOYSA-N
MW198.13 g/mol
LogP0.91
Rot. Bonds

About 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one

4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one (PubChem CID 46211865) has the molecular formula C8H4F2N2O2 and a molecular weight of 198.13 g/mol. Its IUPAC name is 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one
PubChem CID46211865
Molecular FormulaC8H4F2N2O2
Molecular Weight198.13 g/mol
Exact Mass198.02
IUPAC Name4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one
SMILESO=c1[nH]c2nccc(F)c2c(F)c1O
InChIInChI=1S/C8H4F2N2O2/c9-3-1-2-11-7-4(3)5(10)6(13)8(14)12-7/h1-2,13H,(H,11,12,14)
InChIKeyPQGWRZUYRFCHQD-UHFFFAOYSA-N
XLogP0.91
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.13
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one with MolForge

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

Launch Full Analysis

Related Compounds

8-chloro-4-fluoro-3-hydroxy-1H-1,5-naphthyridin-2-one
CID 135894469
5,8-dichloro-4-fluoro-3-hydroxy-1H-quinolin-2-one
CID 68637756
7-(2-fluorophenyl)-8-hydroxy-5H-pyrido[2,3-b]pyrazin-6-one
CID 59769210
1-chloro-6-oxo-5H-benzo[c][1,8]naphthyridine-8-carboxylic acid
CID 123921843
4,8-difluoro-3-hydroxy-1H-1,6-naphthyridin-2-one
CID 46211866
5-chloro-2-oxo-4-phenyl-1H-1,8-naphthyridine-3-carboxylic acid
CID 170985444
4-fluoroquinolin-5-ol
CID 137072790
5-fluoro-4-hydroxy-2-oxo-1H-quinoline-3-carboxylic acid
CID 149159805
1,3-dihydroimidazo[4,5-b]pyrazin-2-one
CID 68856140
4-fluoro-1H-pyrrolo[2,3-b]pyridine-2-carbaldehyde
CID 130062826
4,5,6,7-tetrachloro-3-hydroxy-1H-quinolin-2-one
CID 54144640
1-phenoxy-5H-benzo[c][1,8]naphthyridin-6-one
CID 58168379

Frequently Asked Questions

What is the IUPAC name of 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one?
The IUPAC name of 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one (CID 46211865) is 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one is O=c1[nH]c2nccc(F)c2c(F)c1O.
What is the InChIKey of 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one?
The InChIKey is PQGWRZUYRFCHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F2N2O2/c9-3-1-2-11-7-4(3)5(10)6(13)8(14)12-7/h1-2,13H,(H,11,12,14).
What are the key properties of 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one?
4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one has a molecular weight of 198.13 g/mol, XLogP of 0.91, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-difluoro-3-hydroxy-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 46211865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).