2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide

C14H13FN2O3S — CID 61042650

IUPAC2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide
SMILESCNS(=O)(=O)c1ccccc1NC(=O)c1ccccc1F
InChIInChI=1S/C14H13FN2O3S/c1-16-21(19,20)13-9-5-4-8-12(13)17-14(18)10-6-2-3-7-11(10)15/h2-9,16H,1H3,(H,17,18)
InChIKeyXWLCEKFTFRJTPF-UHFFFAOYSA-N
MW308.33 g/mol
LogP1.99
Rot. Bonds4

About 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide

2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide (PubChem CID 61042650) has the molecular formula C14H13FN2O3S and a molecular weight of 308.33 g/mol. Its IUPAC name is 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide
PubChem CID61042650
Molecular FormulaC14H13FN2O3S
Molecular Weight308.33 g/mol
Exact Mass308.06
IUPAC Name2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide
SMILESCNS(=O)(=O)c1ccccc1NC(=O)c1ccccc1F
InChIInChI=1S/C14H13FN2O3S/c1-16-21(19,20)13-9-5-4-8-12(13)17-14(18)10-6-2-3-7-11(10)15/h2-9,16H,1H3,(H,17,18)
InChIKeyXWLCEKFTFRJTPF-UHFFFAOYSA-N
XLogP1.99
TPSA75.27 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 ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,3-difluorobenzoyl)amino]benzenesulfonyl fluoride
CID 116814244
2-fluoro-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]benzamide
CID 39948261
2-fluoro-N-(2-morpholin-4-ylsulfonylphenyl)benzamide
CID 90451563
2-[(4-chloro-2-fluorobenzoyl)amino]benzenesulfonyl fluoride
CID 116813961
2-bromo-N-[2-(methylsulfamoyl)phenyl]propanamide
CID 107903498
2-amino-3,3,3-trifluoro-2-methyl-N-[2-(methylsulfamoyl)phenyl]propanamide
CID 79789955
2-acetyl-N-methylbenzenesulfonamide
CID 130548930
N-(3-bromo-2-methylphenyl)-2-fluorobenzamide
CID 66606524
5-bromo-4-methyl-N-[2-(methylsulfamoyl)phenyl]thiophene-2-carboxamide
CID 79998270
N-(5-chloro-2-fluorophenyl)-2-methylsulfonylbenzamide
CID 18082595
ethane;2-fluoro-N-methylbenzamide
CID 178102327
2-fluoro-N-methylbenzamide;hydrate
CID 141303255

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide (CID 61042650) is 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide is CNS(=O)(=O)c1ccccc1NC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide?
The InChIKey is XWLCEKFTFRJTPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3S/c1-16-21(19,20)13-9-5-4-8-12(13)17-14(18)10-6-2-3-7-11(10)15/h2-9,16H,1H3,(H,17,18).
What are the key properties of 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide?
2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide has a molecular weight of 308.33 g/mol, XLogP of 1.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-(methylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 61042650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).