5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide

C14H15FN2O4S2 — CID 8519696

IUPAC5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide
SMILESCNS(=O)(=O)c1cc(NS(=O)(=O)c2ccccc2F)ccc1C
InChIInChI=1S/C14H15FN2O4S2/c1-10-7-8-11(9-14(10)22(18,19)16-2)17-23(20,21)13-6-4-3-5-12(13)15/h3-9,16-17H,1-2H3
InChIKeyMEDXBBRHWHLQDG-UHFFFAOYSA-N
MW358.42 g/mol
LogP1.84
Rot. Bonds5

About 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide

5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide (PubChem CID 8519696) has the molecular formula C14H15FN2O4S2 and a molecular weight of 358.42 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide
PubChem CID8519696
Molecular FormulaC14H15FN2O4S2
Molecular Weight358.42 g/mol
Exact Mass358.05
IUPAC Name5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide
SMILESCNS(=O)(=O)c1cc(NS(=O)(=O)c2ccccc2F)ccc1C
InChIInChI=1S/C14H15FN2O4S2/c1-10-7-8-11(9-14(10)22(18,19)16-2)17-23(20,21)13-6-4-3-5-12(13)15/h3-9,16-17H,1-2H3
InChIKeyMEDXBBRHWHLQDG-UHFFFAOYSA-N
XLogP1.84
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.42
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-amino-3-methylphenyl)-2-fluorobenzenesulfonamide
CID 43604765
methyl 2-[[4-methyl-3-(methylsulfamoyl)phenyl]sulfamoyl]benzoate
CID 8519727
N'-(2-fluorophenyl)sulfonyl-2,5-dimethylbenzenesulfonohydrazide
CID 8523599
4-N-[4-methyl-3-(methylsulfamoyl)phenyl]benzene-1,4-disulfonamide
CID 18286970
5-(chloromethylsulfonylamino)-N,2-dimethylbenzenesulfonamide
CID 63664896
N-[4-[[3-[(2-fluorophenyl)sulfamoyl]-4-methylphenyl]sulfamoyl]phenyl]acetamide
CID 26950174
2-methyl-N-[4-methyl-3-[(2-methylphenyl)sulfonylamino]phenyl]benzenesulfonamide
CID 990525
N-(3,4-dimethylphenyl)-2,6-difluorobenzenesulfonamide
CID 4793269
2-fluoro-N-[4-(methylaminomethyl)phenyl]benzenesulfonamide
CID 106911076
2-fluoro-N-(1H-indol-6-yl)benzenesulfonamide
CID 71954733
5-[(4-ethylphenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide
CID 8519772
N-(3-bromophenyl)-2-fluorobenzenesulfonamide
CID 4788445

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide?
The IUPAC name of 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide (CID 8519696) is 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide.
What is the SMILES notation for 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide?
The canonical SMILES for 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide is CNS(=O)(=O)c1cc(NS(=O)(=O)c2ccccc2F)ccc1C.
What is the InChIKey of 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide?
The InChIKey is MEDXBBRHWHLQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O4S2/c1-10-7-8-11(9-14(10)22(18,19)16-2)17-23(20,21)13-6-4-3-5-12(13)15/h3-9,16-17H,1-2H3.
What are the key properties of 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide?
5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide has a molecular weight of 358.42 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)sulfonylamino]-N,2-dimethylbenzenesulfonamide is sourced from PubChem (CID 8519696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).