5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one

C23H15FN2O — CID 11210420

IUPAC5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccc(-c3cccc(F)c3)cc2C1c1ccc2ccccc2n1
InChIInChI=1S/C23H15FN2O/c24-17-6-3-5-15(12-17)16-9-10-20-18(13-16)22(23(27)26-20)21-11-8-14-4-1-2-7-19(14)25-21/h1-13,22H,(H,26,27)
InChIKeyUBGPTAQLZDIVPF-UHFFFAOYSA-N
MW354.38 g/mol
LogP5.12
Rot. Bonds2

About 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one

5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one (PubChem CID 11210420) has the molecular formula C23H15FN2O and a molecular weight of 354.38 g/mol. Its IUPAC name is 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one
PubChem CID11210420
Molecular FormulaC23H15FN2O
Molecular Weight354.38 g/mol
Exact Mass354.12
IUPAC Name5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccc(-c3cccc(F)c3)cc2C1c1ccc2ccccc2n1
InChIInChI=1S/C23H15FN2O/c24-17-6-3-5-15(12-17)16-9-10-20-18(13-16)22(23(27)26-20)21-11-8-14-4-1-2-7-19(14)25-21/h1-13,22H,(H,26,27)
InChIKeyUBGPTAQLZDIVPF-UHFFFAOYSA-N
XLogP5.12
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.38
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one?
The IUPAC name of 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one (CID 11210420) is 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one is O=C1Nc2ccc(-c3cccc(F)c3)cc2C1c1ccc2ccccc2n1.
What is the InChIKey of 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one?
The InChIKey is UBGPTAQLZDIVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15FN2O/c24-17-6-3-5-15(12-17)16-9-10-20-18(13-16)22(23(27)26-20)21-11-8-14-4-1-2-7-19(14)25-21/h1-13,22H,(H,26,27).
What are the key properties of 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one?
5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one has a molecular weight of 354.38 g/mol, XLogP of 5.12, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)-3-quinolin-2-yl-1,3-dihydroindol-2-one is sourced from PubChem (CID 11210420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).