2-(4-fluoro-2-sulfamoylphenoxy)acetic acid

C8H8FNO5S — CID 62103698

IUPAC2-(4-fluoro-2-sulfamoylphenoxy)acetic acid
SMILESNS(=O)(=O)c1cc(F)ccc1OCC(=O)O
InChIInChI=1S/C8H8FNO5S/c9-5-1-2-6(15-4-8(11)12)7(3-5)16(10,13)14/h1-3H,4H2,(H,11,12)(H2,10,13,14)
InChIKeyRKMIQTQQDYBUDW-UHFFFAOYSA-N
MW249.22 g/mol
LogP-0.06
Rot. Bonds4

About 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid

2-(4-fluoro-2-sulfamoylphenoxy)acetic acid (PubChem CID 62103698) has the molecular formula C8H8FNO5S and a molecular weight of 249.22 g/mol. Its IUPAC name is 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid.

Molecular Properties

Compound Name2-(4-fluoro-2-sulfamoylphenoxy)acetic acid
PubChem CID62103698
Molecular FormulaC8H8FNO5S
Molecular Weight249.22 g/mol
Exact Mass249.01
IUPAC Name2-(4-fluoro-2-sulfamoylphenoxy)acetic acid
SMILESNS(=O)(=O)c1cc(F)ccc1OCC(=O)O
InChIInChI=1S/C8H8FNO5S/c9-5-1-2-6(15-4-8(11)12)7(3-5)16(10,13)14/h1-3H,4H2,(H,11,12)(H2,10,13,14)
InChIKeyRKMIQTQQDYBUDW-UHFFFAOYSA-N
XLogP-0.06
TPSA106.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.22
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluoro-2-sulfamoylphenoxy)-N-(2,2,2-trifluoroethyl)acetamide
CID 82917421
N-cyclopentyl-2-(4-fluoro-2-sulfamoylphenoxy)acetamide
CID 82916135
5-fluoro-2-(2-morpholin-4-yl-2-oxoethoxy)benzenesulfonamide
CID 82915954
5-fluoro-2-(3-fluoropropoxy)benzenesulfonamide
CID 81113508
5-fluoro-2-(3-methylbut-3-enoxy)benzenesulfonamide
CID 114473030
2-(3,3-dimethylbutoxy)-5-fluorobenzenesulfonamide
CID 62105180
2-(carboxymethoxy)-5-fluorobenzoic acid
CID 13013035
4-(4-fluoro-2-sulfamoylphenoxy)-N-methylbutanamide
CID 82915136
2-[(4-chlorophenyl)methoxy]-5-fluorobenzenesulfonamide
CID 62105360
2-(5-fluoro-2-sulfamoylphenyl)acetic acid
CID 141356629
2-[(5-chloro-2-fluorophenyl)methoxy]-5-fluorobenzenesulfonamide
CID 103047119
2-(2-bromo-4-sulfamoylphenoxy)acetic acid
CID 43164345

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid?
The IUPAC name of 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid (CID 62103698) is 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid.
What is the SMILES notation for 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid?
The canonical SMILES for 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid is NS(=O)(=O)c1cc(F)ccc1OCC(=O)O.
What is the InChIKey of 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid?
The InChIKey is RKMIQTQQDYBUDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO5S/c9-5-1-2-6(15-4-8(11)12)7(3-5)16(10,13)14/h1-3H,4H2,(H,11,12)(H2,10,13,14).
What are the key properties of 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid?
2-(4-fluoro-2-sulfamoylphenoxy)acetic acid has a molecular weight of 249.22 g/mol, XLogP of -0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-sulfamoylphenoxy)acetic acid is sourced from PubChem (CID 62103698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).