4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide

C16H15FN2O3S — CID 110788495

IUPAC4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide
SMILESO=C1Cc2cc(CCNS(=O)(=O)c3ccc(F)cc3)ccc2N1
InChIInChI=1S/C16H15FN2O3S/c17-13-2-4-14(5-3-13)23(21,22)18-8-7-11-1-6-15-12(9-11)10-16(20)19-15/h1-6,9,18H,7-8,10H2,(H,19,20)
InChIKeyFYAGILUIZLPVHN-UHFFFAOYSA-N
MW334.37 g/mol
LogP1.84
Rot. Bonds5

About 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide

4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide (PubChem CID 110788495) has the molecular formula C16H15FN2O3S and a molecular weight of 334.37 g/mol. Its IUPAC name is 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide
PubChem CID110788495
Molecular FormulaC16H15FN2O3S
Molecular Weight334.37 g/mol
Exact Mass334.08
IUPAC Name4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide
SMILESO=C1Cc2cc(CCNS(=O)(=O)c3ccc(F)cc3)ccc2N1
InChIInChI=1S/C16H15FN2O3S/c17-13-2-4-14(5-3-13)23(21,22)18-8-7-11-1-6-15-12(9-11)10-16(20)19-15/h1-6,9,18H,7-8,10H2,(H,19,20)
InChIKeyFYAGILUIZLPVHN-UHFFFAOYSA-N
XLogP1.84
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.37
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide?
The IUPAC name of 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide (CID 110788495) is 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide is O=C1Cc2cc(CCNS(=O)(=O)c3ccc(F)cc3)ccc2N1.
What is the InChIKey of 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide?
The InChIKey is FYAGILUIZLPVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O3S/c17-13-2-4-14(5-3-13)23(21,22)18-8-7-11-1-6-15-12(9-11)10-16(20)19-15/h1-6,9,18H,7-8,10H2,(H,19,20).
What are the key properties of 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide?
4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide has a molecular weight of 334.37 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-(2-oxo-1,3-dihydroindol-5-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 110788495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).