5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one

C15H11ClFNO2 — CID 66618555

IUPAC5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one
SMILESCOc1cc2c(cc1Cl)C(c1ccccc1F)C(=O)N2
InChIInChI=1S/C15H11ClFNO2/c1-20-13-7-12-9(6-10(13)16)14(15(19)18-12)8-4-2-3-5-11(8)17/h2-7,14H,1H3,(H,18,19)
InChIKeyAUEVYRZXRFHWKL-UHFFFAOYSA-N
MW291.71 g/mol
LogP3.57
Rot. Bonds2

About 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one

5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one (PubChem CID 66618555) has the molecular formula C15H11ClFNO2 and a molecular weight of 291.71 g/mol. Its IUPAC name is 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one
PubChem CID66618555
Molecular FormulaC15H11ClFNO2
Molecular Weight291.71 g/mol
Exact Mass291.05
IUPAC Name5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one
SMILESCOc1cc2c(cc1Cl)C(c1ccccc1F)C(=O)N2
InChIInChI=1S/C15H11ClFNO2/c1-20-13-7-12-9(6-10(13)16)14(15(19)18-12)8-4-2-3-5-11(8)17/h2-7,14H,1H3,(H,18,19)
InChIKeyAUEVYRZXRFHWKL-UHFFFAOYSA-N
XLogP3.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.71
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one?
The IUPAC name of 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one (CID 66618555) is 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one?
The canonical SMILES for 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one is COc1cc2c(cc1Cl)C(c1ccccc1F)C(=O)N2.
What is the InChIKey of 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one?
The InChIKey is AUEVYRZXRFHWKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFNO2/c1-20-13-7-12-9(6-10(13)16)14(15(19)18-12)8-4-2-3-5-11(8)17/h2-7,14H,1H3,(H,18,19).
What are the key properties of 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one?
5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one has a molecular weight of 291.71 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(2-fluorophenyl)-6-methoxy-1,3-dihydroindol-2-one is sourced from PubChem (CID 66618555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).