5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid

C11H8FNO4S2 — CID 43474985

IUPAC5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid
SMILESO=C(O)c1ccc(NS(=O)(=O)c2ccccc2F)s1
InChIInChI=1S/C11H8FNO4S2/c12-7-3-1-2-4-9(7)19(16,17)13-10-6-5-8(18-10)11(14)15/h1-6,13H,(H,14,15)
InChIKeyFEHHANXZOTVTEG-UHFFFAOYSA-N
MW301.32 g/mol
LogP2.39
Rot. Bonds4

About 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid

5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid (PubChem CID 43474985) has the molecular formula C11H8FNO4S2 and a molecular weight of 301.32 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid.

Molecular Properties

Compound Name5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid
PubChem CID43474985
Molecular FormulaC11H8FNO4S2
Molecular Weight301.32 g/mol
Exact Mass300.99
IUPAC Name5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid
SMILESO=C(O)c1ccc(NS(=O)(=O)c2ccccc2F)s1
InChIInChI=1S/C11H8FNO4S2/c12-7-3-1-2-4-9(7)19(16,17)13-10-6-5-8(18-10)11(14)15/h1-6,13H,(H,14,15)
InChIKeyFEHHANXZOTVTEG-UHFFFAOYSA-N
XLogP2.39
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.32
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(2-bromo-4,6-difluorophenyl)sulfonylamino]thiophene-2-carboxylic acid
CID 43475078
3-[(2-fluorophenyl)sulfonylamino]naphthalene-2-carboxylic acid
CID 16776827
4-[(2-fluorophenyl)sulfamoyl]-5-methylthiophene-2-carboxylic acid
CID 63327927
5-[(4-ethylphenyl)sulfonylamino]thiophene-2-carboxylic acid
CID 43475054
5-[1-(2-fluorophenyl)ethylsulfamoyl]thiophene-2-carboxylic acid
CID 61027369
4-[2-[4-[(2-fluorophenyl)sulfonylamino]phenyl]ethyl]benzoic acid
CID 68689846
5-[(2,3,4-trifluorophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 61026611
2-[[5-[(2-fluorophenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid
CID 61283777
3-bromo-2-chloro-6-[(2-fluorophenyl)sulfonylamino]benzoic acid
CID 68863143
methyl 2-[(2-fluorophenyl)sulfonylamino]-4,5-dimethoxybenzoate
CID 2480010
5-[(5-chloro-2-fluorophenyl)sulfamoyl]thiophene-2-carboxylic acid
CID 61026497
5-[(4-chloro-1-methylpyrazol-5-yl)sulfonylamino]thiophene-2-carboxylic acid
CID 106313993

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid?
The IUPAC name of 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid (CID 43474985) is 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid.
What is the SMILES notation for 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid?
The canonical SMILES for 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid is O=C(O)c1ccc(NS(=O)(=O)c2ccccc2F)s1.
What is the InChIKey of 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid?
The InChIKey is FEHHANXZOTVTEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FNO4S2/c12-7-3-1-2-4-9(7)19(16,17)13-10-6-5-8(18-10)11(14)15/h1-6,13H,(H,14,15).
What are the key properties of 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid?
5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid has a molecular weight of 301.32 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)sulfonylamino]thiophene-2-carboxylic acid is sourced from PubChem (CID 43474985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).