4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide

C14H13FN2O3S — CID 61036384

IUPAC4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide
SMILESCc1c(NC(=O)c2ccc(F)cc2)cccc1S(N)(=O)=O
InChIInChI=1S/C14H13FN2O3S/c1-9-12(3-2-4-13(9)21(16,19)20)17-14(18)10-5-7-11(15)8-6-10/h2-8H,1H3,(H,17,18)(H2,16,19,20)
InChIKeyMITGWZDRPLODKC-UHFFFAOYSA-N
MW308.33 g/mol
LogP2.03
Rot. Bonds3

About 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide

4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide (PubChem CID 61036384) has the molecular formula C14H13FN2O3S and a molecular weight of 308.33 g/mol. Its IUPAC name is 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide
PubChem CID61036384
Molecular FormulaC14H13FN2O3S
Molecular Weight308.33 g/mol
Exact Mass308.06
IUPAC Name4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide
SMILESCc1c(NC(=O)c2ccc(F)cc2)cccc1S(N)(=O)=O
InChIInChI=1S/C14H13FN2O3S/c1-9-12(3-2-4-13(9)21(16,19)20)17-14(18)10-5-7-11(15)8-6-10/h2-8H,1H3,(H,17,18)(H2,16,19,20)
InChIKeyMITGWZDRPLODKC-UHFFFAOYSA-N
XLogP2.03
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-iodo-N-(2-methyl-3-sulfamoylphenyl)benzamide
CID 61034623
N-(2,3-dimethylphenyl)-4-fluorobenzamide
CID 795282
4-[2-(4-fluorophenyl)ethynyl]-N-(2-sulfamoylphenyl)benzamide
CID 12018921
2-fluoro-N-(2-methyl-3-sulfamoylphenyl)pyridine-4-carboxamide
CID 61293813
4-fluoro-N-(3-iodo-2-methylphenyl)benzamide
CID 113368778
N-(2-methyl-3-sulfamoylphenyl)-1,2-oxazole-5-carboxamide
CID 61130286
6-methyl-N-(2-methyl-3-sulfamoylphenyl)pyridine-2-carboxamide
CID 61129334
N-(2,3-dimethylphenyl)-4-[(4-fluorophenyl)sulfonylamino]benzamide
CID 8015612
4-tert-butyl-N-[2-[(4-fluorobenzoyl)amino]phenyl]benzamide
CID 10500600
4-fluoro-N-(2-methyl-3-pyridinyl)benzamide
CID 79041653
4-fluoro-N-[2-(methanesulfonamido)phenyl]benzamide
CID 35368090
N-(4-fluorophenyl)-4-methyl-3-sulfamoylbenzamide
CID 9070427

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide?
The IUPAC name of 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide (CID 61036384) is 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide?
The canonical SMILES for 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide is Cc1c(NC(=O)c2ccc(F)cc2)cccc1S(N)(=O)=O.
What is the InChIKey of 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide?
The InChIKey is MITGWZDRPLODKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O3S/c1-9-12(3-2-4-13(9)21(16,19)20)17-14(18)10-5-7-11(15)8-6-10/h2-8H,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide?
4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide has a molecular weight of 308.33 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-methyl-3-sulfamoylphenyl)benzamide is sourced from PubChem (CID 61036384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).