6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one

C19H12F2N2O2 — CID 25061068

IUPAC6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one
SMILESO=C1Nc2c(ccc(F)c2F)C1(c1ccc(O)cc1)c1cccnc1
InChIInChI=1S/C19H12F2N2O2/c20-15-8-7-14-17(16(15)21)23-18(25)19(14,12-2-1-9-22-10-12)11-3-5-13(24)6-4-11/h1-10,24H,(H,23,25)
InChIKeyFCZHRTBNLCOFCA-UHFFFAOYSA-N
MW338.31 g/mol
LogP3.35
Rot. Bonds2

About 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one

6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one (PubChem CID 25061068) has the molecular formula C19H12F2N2O2 and a molecular weight of 338.31 g/mol. Its IUPAC name is 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one.

Molecular Properties

Compound Name6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one
PubChem CID25061068
Molecular FormulaC19H12F2N2O2
Molecular Weight338.31 g/mol
Exact Mass338.09
IUPAC Name6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one
SMILESO=C1Nc2c(ccc(F)c2F)C1(c1ccc(O)cc1)c1cccnc1
InChIInChI=1S/C19H12F2N2O2/c20-15-8-7-14-17(16(15)21)23-18(25)19(14,12-2-1-9-22-10-12)11-3-5-13(24)6-4-11/h1-10,24H,(H,23,25)
InChIKeyFCZHRTBNLCOFCA-UHFFFAOYSA-N
XLogP3.35
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.31
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one?
The IUPAC name of 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one (CID 25061068) is 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one.
What is the SMILES notation for 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one?
The canonical SMILES for 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one is O=C1Nc2c(ccc(F)c2F)C1(c1ccc(O)cc1)c1cccnc1.
What is the InChIKey of 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one?
The InChIKey is FCZHRTBNLCOFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F2N2O2/c20-15-8-7-14-17(16(15)21)23-18(25)19(14,12-2-1-9-22-10-12)11-3-5-13(24)6-4-11/h1-10,24H,(H,23,25).
What are the key properties of 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one?
6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one has a molecular weight of 338.31 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-difluoro-3-(4-hydroxyphenyl)-3-pyridin-3-yl-1H-indol-2-one is sourced from PubChem (CID 25061068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).