4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide

C14H13FN2O3S — CID 24632207

IUPAC4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C14H13FN2O3S/c15-12-5-3-11(4-6-12)14(18)17-13-7-1-10(2-8-13)9-21(16,19)20/h1-8H,9H2,(H,17,18)(H2,16,19,20)
InChIKeyRWVRHICVFHLHBV-UHFFFAOYSA-N
MW308.33 g/mol
LogP1.87
Rot. Bonds4

About 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide

4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide (PubChem CID 24632207) has the molecular formula C14H13FN2O3S and a molecular weight of 308.33 g/mol. Its IUPAC name is 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide
PubChem CID24632207
Molecular FormulaC14H13FN2O3S
Molecular Weight308.33 g/mol
Exact Mass308.06
IUPAC Name4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C14H13FN2O3S/c15-12-5-3-11(4-6-12)14(18)17-13-7-1-10(2-8-13)9-21(16,19)20/h1-8H,9H2,(H,17,18)(H2,16,19,20)
InChIKeyRWVRHICVFHLHBV-UHFFFAOYSA-N
XLogP1.87
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.33
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2-[(4-fluorobenzoyl)amino]-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 24669131
4-fluoro-N-[4-[(4-fluorophenyl)methylamino]phenyl]benzamide
CID 112982456
4-N-(4-fluorophenyl)-1-N-[(4-fluorophenyl)methyl]benzene-1,4-dicarboxamide
CID 109047271
3,4-diethoxy-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 55551961
N-(4-fluorophenyl)-4-[2-(methanesulfonamido)ethyl]benzamide
CID 18100481
potassium;(4-fluorophenyl)methanesulfonamide;hydride
CID 175451453
N-(4-carbamothioylphenyl)-4-fluorobenzamide
CID 24710557
5-hydroxy-N-[4-(sulfamoylmethyl)phenyl]pyridine-3-carboxamide
CID 63851733
1-N-(4-acetylphenyl)-4-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049917
N-(3,5-difluorophenyl)-4-(methylsulfonylmethyl)benzamide
CID 27054975
N-[4-[(4-fluorophenyl)sulfamoyl]phenyl]-4-(piperidin-1-ylsulfonylmethyl)benzamide
CID 99957022
1-N-[(4-fluorophenyl)methyl]-4-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109047255

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide?
The IUPAC name of 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide (CID 24632207) is 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide?
The canonical SMILES for 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide is NS(=O)(=O)Cc1ccc(NC(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide?
The InChIKey is RWVRHICVFHLHBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3S/c15-12-5-3-11(4-6-12)14(18)17-13-7-1-10(2-8-13)9-21(16,19)20/h1-8H,9H2,(H,17,18)(H2,16,19,20).
What are the key properties of 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide?
4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide has a molecular weight of 308.33 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[4-(sulfamoylmethyl)phenyl]benzamide is sourced from PubChem (CID 24632207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).