4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide

C16H15FN2O4S — CID 4850003

IUPAC4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide
SMILESNS(=O)(=O)c1ccc(NC(=O)CCC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C16H15FN2O4S/c17-12-3-1-11(2-4-12)15(20)9-10-16(21)19-13-5-7-14(8-6-13)24(18,22)23/h1-8H,9-10H2,(H,19,21)(H2,18,22,23)
InChIKeyRZGGFXHYFGLNQI-UHFFFAOYSA-N
MW350.37 g/mol
LogP2.07
Rot. Bonds6

About 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide

4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide (PubChem CID 4850003) has the molecular formula C16H15FN2O4S and a molecular weight of 350.37 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide
PubChem CID4850003
Molecular FormulaC16H15FN2O4S
Molecular Weight350.37 g/mol
Exact Mass350.07
IUPAC Name4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide
SMILESNS(=O)(=O)c1ccc(NC(=O)CCC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C16H15FN2O4S/c17-12-3-1-11(2-4-12)15(20)9-10-16(21)19-13-5-7-14(8-6-13)24(18,22)23/h1-8H,9-10H2,(H,19,21)(H2,18,22,23)
InChIKeyRZGGFXHYFGLNQI-UHFFFAOYSA-N
XLogP2.07
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.37
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-fluorophenyl)-N-(4-hydroxyphenyl)-4-oxobutanamide
CID 51186783
N-[4-(diethylsulfamoyl)phenyl]-4-(4-fluorophenyl)-4-oxobutanamide
CID 9415960
4-(4-chlorophenyl)-N-(4-fluorophenyl)-4-oxobutanamide
CID 42029067
N-(4-anilinophenyl)-4-(4-fluorophenyl)-4-oxobutanamide
CID 46467442
N-(4-fluorophenyl)-N'-(4-sulfamoylphenyl)oxamide
CID 108508654
4-oxo-4-(4-pentoxyphenyl)-N-(4-sulfamoylphenyl)butanamide
CID 2121886
N-[4-(cyclohexylsulfamoyl)phenyl]-4-(4-fluorophenyl)-4-oxobutanamide
CID 108807070
3-amino-N-(4-sulfamoylphenyl)propanamide
CID 10776616
N-(3,4-difluorophenyl)-4-(4-fluorophenyl)-4-oxobutanamide
CID 9165788
N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]-4-(4-fluorophenyl)-4-oxobutanamide
CID 26712109
N-(4-fluorophenyl)-2-[(4-sulfamoylphenyl)methylamino]acetamide
CID 17066843
2-methylpropyl 4-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]benzoate
CID 108795614

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide?
The IUPAC name of 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide (CID 4850003) is 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide.
What is the SMILES notation for 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide?
The canonical SMILES for 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide is NS(=O)(=O)c1ccc(NC(=O)CCC(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide?
The InChIKey is RZGGFXHYFGLNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O4S/c17-12-3-1-11(2-4-12)15(20)9-10-16(21)19-13-5-7-14(8-6-13)24(18,22)23/h1-8H,9-10H2,(H,19,21)(H2,18,22,23).
What are the key properties of 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide?
4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide has a molecular weight of 350.37 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-4-oxo-N-(4-sulfamoylphenyl)butanamide is sourced from PubChem (CID 4850003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).