4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide

C9H10FNO2S — CID 175173681

IUPAC4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide
SMILESC=C(C)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C9H10FNO2S/c1-7(2)11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,1H2,2H3
InChIKeyQXULSXSYBGAXPN-UHFFFAOYSA-N
MW215.25 g/mol
LogP1.64
Rot. Bonds3

About 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide

4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide (PubChem CID 175173681) has the molecular formula C9H10FNO2S and a molecular weight of 215.25 g/mol. Its IUPAC name is 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide
PubChem CID175173681
Molecular FormulaC9H10FNO2S
Molecular Weight215.25 g/mol
Exact Mass215.04
IUPAC Name4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide
SMILESC=C(C)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C9H10FNO2S/c1-7(2)11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,1H2,2H3
InChIKeyQXULSXSYBGAXPN-UHFFFAOYSA-N
XLogP1.64
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-N-(2-methylprop-2-enyl)benzenesulfonamide
CID 114616524
N-(4-fluorophenyl)sulfonyl-2-methylpropanamide
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CID 25044330
ethyl N-(4-fluorophenyl)sulfonylcarbamate
CID 19693765
2-(4-fluorophenyl)-N-(4-fluorophenyl)sulfonylacetamide
CID 56683687
[(Z)-4-[(4-fluorophenyl)sulfonylcarbamoyloxy]but-2-enyl] acetate
CID 102021540
N-[4-(acetylsulfamoyl)phenyl]-2-(4-fluorophenyl)acetamide
CID 3379076
2-(4-fluorophenoxy)-N-(4-fluorophenyl)sulfonyl-2-methylpropanamide
CID 87011295
N-(4-fluorophenyl)sulfonylpyrrolidine-2-carboxamide
CID 146156641
5-chloro-N-[(3E,5E)-5-[(4-fluorophenyl)sulfonylamino]-2-methylhepta-1,3,5-trien-4-yl]thiophene-2-sulfonamide
CID 131968435
3-N,5-N-bis[(4-fluorophenyl)sulfonyl]pyridine-3,5-dicarboxamide
CID 57399860
(4-fluorophenyl)-hydroxy-methylidene-oxo-λ6-sulfane
CID 91455649

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide?
The IUPAC name of 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide (CID 175173681) is 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide?
The canonical SMILES for 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide is C=C(C)NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide?
The InChIKey is QXULSXSYBGAXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2S/c1-7(2)11-14(12,13)9-5-3-8(10)4-6-9/h3-6,11H,1H2,2H3.
What are the key properties of 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide?
4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide has a molecular weight of 215.25 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-prop-1-en-2-ylbenzenesulfonamide is sourced from PubChem (CID 175173681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).