5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one

C18H12FNO3 — CID 101433320

IUPAC5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one
SMILESO=C1Nc2ccc(F)cc2C1(O)c1c(O)ccc2ccccc12
InChIInChI=1S/C18H12FNO3/c19-11-6-7-14-13(9-11)18(23,17(22)20-14)16-12-4-2-1-3-10(12)5-8-15(16)21/h1-9,21,23H,(H,20,22)
InChIKeyWAXPGDWLZSXNRL-UHFFFAOYSA-N
MW309.30 g/mol
LogP2.87
Rot. Bonds1

About 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one

5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one (PubChem CID 101433320) has the molecular formula C18H12FNO3 and a molecular weight of 309.30 g/mol. Its IUPAC name is 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one.

Molecular Properties

Compound Name5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one
PubChem CID101433320
Molecular FormulaC18H12FNO3
Molecular Weight309.30 g/mol
Exact Mass309.08
IUPAC Name5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one
SMILESO=C1Nc2ccc(F)cc2C1(O)c1c(O)ccc2ccccc12
InChIInChI=1S/C18H12FNO3/c19-11-6-7-14-13(9-11)18(23,17(22)20-14)16-12-4-2-1-3-10(12)5-8-15(16)21/h1-9,21,23H,(H,20,22)
InChIKeyWAXPGDWLZSXNRL-UHFFFAOYSA-N
XLogP2.87
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.30
LogP ≤ 52.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-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

3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-5-iodo-1H-indol-2-one
CID 101433323
(3R)-5-fluoro-3-hydroxy-3-(2-naphthalen-1-yl-2-oxoethyl)-1H-indol-2-one
CID 7693260
(1R)-1-hydroxy-1-(trifluoromethyl)-3H-benzo[e]indol-2-one
CID 7689726
3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one
CID 83036180
3-(5-chloro-2-pyridinyl)-5-fluoro-3-hydroxy-1H-indol-2-one
CID 163232440
5-fluoro-3-hydroxy-3-phenacyl-1H-indol-2-one
CID 2944765
5-fluoro-3-hydroxy-3-(5-methyl-1H-indol-3-yl)-1H-indol-2-one
CID 118710068
5-fluoro-3-(naphthalen-1-ylamino)-1,3-dihydroindol-2-one
CID 43824875
5-chloro-3-(2-chloro-4-fluorophenyl)-3-hydroxy-1H-indol-2-one
CID 18753035
4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one
CID 163232544
(3R)-3-hydroxy-3-(2-hydroxyphenyl)-1H-indol-2-one
CID 7102076
5-fluoro-3,3-bis(4-hydroxyphenyl)-1H-indol-2-one
CID 11559077

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one?
The IUPAC name of 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one (CID 101433320) is 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one.
What is the SMILES notation for 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one?
The canonical SMILES for 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one is O=C1Nc2ccc(F)cc2C1(O)c1c(O)ccc2ccccc12.
What is the InChIKey of 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one?
The InChIKey is WAXPGDWLZSXNRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FNO3/c19-11-6-7-14-13(9-11)18(23,17(22)20-14)16-12-4-2-1-3-10(12)5-8-15(16)21/h1-9,21,23H,(H,20,22).
What are the key properties of 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one?
5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one has a molecular weight of 309.30 g/mol, XLogP of 2.87, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-hydroxy-3-(2-hydroxynaphthalen-1-yl)-1H-indol-2-one is sourced from PubChem (CID 101433320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).