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

C16H10F2N2O2 — CID 118710082

IUPAC5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one
SMILESO=C1Nc2ccc(F)cc2C1(O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C16H10F2N2O2/c17-8-1-3-13-10(5-8)12(7-19-13)16(22)11-6-9(18)2-4-14(11)20-15(16)21/h1-7,19,22H,(H,20,21)
InChIKeyDFEUULWUVRJUIL-UHFFFAOYSA-N
MW300.26 g/mol
LogP2.63
Rot. Bonds1

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

5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one (PubChem CID 118710082) has the molecular formula C16H10F2N2O2 and a molecular weight of 300.26 g/mol. Its IUPAC name is 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one.

Molecular Properties

Compound Name5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one
PubChem CID118710082
Molecular FormulaC16H10F2N2O2
Molecular Weight300.26 g/mol
Exact Mass300.07
IUPAC Name5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one
SMILESO=C1Nc2ccc(F)cc2C1(O)c1c[nH]c2ccc(F)cc12
InChIInChI=1S/C16H10F2N2O2/c17-8-1-3-13-10(5-8)12(7-19-13)16(22)11-6-9(18)2-4-14(11)20-15(16)21/h1-7,19,22H,(H,20,21)
InChIKeyDFEUULWUVRJUIL-UHFFFAOYSA-N
XLogP2.63
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.26
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one?
The IUPAC name of 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one (CID 118710082) is 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one.
What is the SMILES notation for 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one?
The canonical SMILES for 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one is O=C1Nc2ccc(F)cc2C1(O)c1c[nH]c2ccc(F)cc12.
What is the InChIKey of 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one?
The InChIKey is DFEUULWUVRJUIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F2N2O2/c17-8-1-3-13-10(5-8)12(7-19-13)16(22)11-6-9(18)2-4-14(11)20-15(16)21/h1-7,19,22H,(H,20,21).
What are the key properties of 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one?
5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one has a molecular weight of 300.26 g/mol, XLogP of 2.63, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-3-(5-fluoro-1H-indol-3-yl)-3-hydroxy-1H-indol-2-one is sourced from PubChem (CID 118710082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).