3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one

C14H9F2NO2 — CID 83036180

IUPAC3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one
SMILESO=C1Nc2ccccc2C1(O)c1c(F)cccc1F
InChIInChI=1S/C14H9F2NO2/c15-9-5-3-6-10(16)12(9)14(19)8-4-1-2-7-11(8)17-13(14)18/h1-7,19H,(H,17,18)
InChIKeyXILALIHJUMNEJE-UHFFFAOYSA-N
MW261.23 g/mol
LogP2.15
Rot. Bonds1

About 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one

3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one (PubChem CID 83036180) has the molecular formula C14H9F2NO2 and a molecular weight of 261.23 g/mol. Its IUPAC name is 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one.

Molecular Properties

Compound Name3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one
PubChem CID83036180
Molecular FormulaC14H9F2NO2
Molecular Weight261.23 g/mol
Exact Mass261.06
IUPAC Name3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one
SMILESO=C1Nc2ccccc2C1(O)c1c(F)cccc1F
InChIInChI=1S/C14H9F2NO2/c15-9-5-3-6-10(16)12(9)14(19)8-4-1-2-7-11(8)17-13(14)18/h1-7,19H,(H,17,18)
InChIKeyXILALIHJUMNEJE-UHFFFAOYSA-N
XLogP2.15
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.23
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one?
The IUPAC name of 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one (CID 83036180) is 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one.
What is the SMILES notation for 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one?
The canonical SMILES for 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one is O=C1Nc2ccccc2C1(O)c1c(F)cccc1F.
What is the InChIKey of 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one?
The InChIKey is XILALIHJUMNEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2NO2/c15-9-5-3-6-10(16)12(9)14(19)8-4-1-2-7-11(8)17-13(14)18/h1-7,19H,(H,17,18).
What are the key properties of 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one?
3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one has a molecular weight of 261.23 g/mol, XLogP of 2.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-difluorophenyl)-3-hydroxy-1H-indol-2-one is sourced from PubChem (CID 83036180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).