4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one

C14H8F3NO2 — CID 163232544

IUPAC4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one
SMILESO=C1Nc2cc(F)cc(F)c2C1(O)c1ccccc1F
InChIInChI=1S/C14H8F3NO2/c15-7-5-10(17)12-11(6-7)18-13(19)14(12,20)8-3-1-2-4-9(8)16/h1-6,20H,(H,18,19)
InChIKeyGMRGLTOZFAUQSV-UHFFFAOYSA-N
MW279.22 g/mol
LogP2.29
Rot. Bonds1

About 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one

4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one (PubChem CID 163232544) has the molecular formula C14H8F3NO2 and a molecular weight of 279.22 g/mol. Its IUPAC name is 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one.

Molecular Properties

Compound Name4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one
PubChem CID163232544
Molecular FormulaC14H8F3NO2
Molecular Weight279.22 g/mol
Exact Mass279.05
IUPAC Name4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one
SMILESO=C1Nc2cc(F)cc(F)c2C1(O)c1ccccc1F
InChIInChI=1S/C14H8F3NO2/c15-7-5-10(17)12-11(6-7)18-13(19)14(12,20)8-3-1-2-4-9(8)16/h1-6,20H,(H,18,19)
InChIKeyGMRGLTOZFAUQSV-UHFFFAOYSA-N
XLogP2.29
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.22
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one?
The IUPAC name of 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one (CID 163232544) is 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one.
What is the SMILES notation for 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one?
The canonical SMILES for 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one is O=C1Nc2cc(F)cc(F)c2C1(O)c1ccccc1F.
What is the InChIKey of 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one?
The InChIKey is GMRGLTOZFAUQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F3NO2/c15-7-5-10(17)12-11(6-7)18-13(19)14(12,20)8-3-1-2-4-9(8)16/h1-6,20H,(H,18,19).
What are the key properties of 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one?
4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one has a molecular weight of 279.22 g/mol, XLogP of 2.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-difluoro-3-(2-fluorophenyl)-3-hydroxy-1H-indol-2-one is sourced from PubChem (CID 163232544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).