7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one

C13H8F2N2O — CID 58255499

IUPAC7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3cncc(F)c3)cc(F)c2N1
InChIInChI=1S/C13H8F2N2O/c14-10-2-9(5-16-6-10)7-1-8-4-12(18)17-13(8)11(15)3-7/h1-3,5-6H,4H2,(H,17,18)
InChIKeyUFTBNHXWBRPGFX-UHFFFAOYSA-N
MW246.22 g/mol
LogP2.52
Rot. Bonds1

About 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one

7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one (PubChem CID 58255499) has the molecular formula C13H8F2N2O and a molecular weight of 246.22 g/mol. Its IUPAC name is 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one
PubChem CID58255499
Molecular FormulaC13H8F2N2O
Molecular Weight246.22 g/mol
Exact Mass246.06
IUPAC Name7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3cncc(F)c3)cc(F)c2N1
InChIInChI=1S/C13H8F2N2O/c14-10-2-9(5-16-6-10)7-1-8-4-12(18)17-13(8)11(15)3-7/h1-3,5-6H,4H2,(H,17,18)
InChIKeyUFTBNHXWBRPGFX-UHFFFAOYSA-N
XLogP2.52
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.22
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one (CID 58255499) is 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(-c3cncc(F)c3)cc(F)c2N1.
What is the InChIKey of 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one?
The InChIKey is UFTBNHXWBRPGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8F2N2O/c14-10-2-9(5-16-6-10)7-1-8-4-12(18)17-13(8)11(15)3-7/h1-3,5-6H,4H2,(H,17,18).
What are the key properties of 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one?
7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one has a molecular weight of 246.22 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 58255499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).