2,5-difluoro-N-methyl-3-sulfamoylbenzamide

C8H8F2N2O3S — CID 65373274

IUPAC2,5-difluoro-N-methyl-3-sulfamoylbenzamide
SMILESCNC(=O)c1cc(F)cc(S(N)(=O)=O)c1F
InChIInChI=1S/C8H8F2N2O3S/c1-12-8(13)5-2-4(9)3-6(7(5)10)16(11,14)15/h2-3H,1H3,(H,12,13)(H2,11,14,15)
InChIKeyFMCFGKGSRPNZPS-UHFFFAOYSA-N
MW250.23 g/mol
LogP-0.03
Rot. Bonds2

About 2,5-difluoro-N-methyl-3-sulfamoylbenzamide

2,5-difluoro-N-methyl-3-sulfamoylbenzamide (PubChem CID 65373274) has the molecular formula C8H8F2N2O3S and a molecular weight of 250.23 g/mol. Its IUPAC name is 2,5-difluoro-N-methyl-3-sulfamoylbenzamide.

Molecular Properties

Compound Name2,5-difluoro-N-methyl-3-sulfamoylbenzamide
PubChem CID65373274
Molecular FormulaC8H8F2N2O3S
Molecular Weight250.23 g/mol
Exact Mass250.02
IUPAC Name2,5-difluoro-N-methyl-3-sulfamoylbenzamide
SMILESCNC(=O)c1cc(F)cc(S(N)(=O)=O)c1F
InChIInChI=1S/C8H8F2N2O3S/c1-12-8(13)5-2-4(9)3-6(7(5)10)16(11,14)15/h2-3H,1H3,(H,12,13)(H2,11,14,15)
InChIKeyFMCFGKGSRPNZPS-UHFFFAOYSA-N
XLogP-0.03
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.23
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-difluoro-3-(methylcarbamoyl)benzenesulfonyl chloride
CID 65367632
2,3,5-trifluoro-N-methylbenzamide
CID 58656809
N-(1-cyclopropylethyl)-2,5-difluoro-3-sulfamoylbenzamide
CID 65386252
2,5-difluoro-3-sulfamoyl-N-(3,3,3-trifluoropropyl)benzamide
CID 65388478
2-bromo-5-fluoro-3-(methylcarbamoyl)benzenesulfonyl chloride
CID 65367980
N-cyclopropyl-2,5-difluoro-N-methyl-3-sulfamoylbenzamide
CID 65373323
3-(3,4-dimethylpyrrolidine-1-carbonyl)-2,5-difluorobenzenesulfonamide
CID 79179822
2,5-difluoro-N-propan-2-yl-N-propyl-3-sulfamoylbenzamide
CID 65387362
2,5-difluoro-N-methyl-N-pentyl-3-sulfamoylbenzamide
CID 65387387
2,5-difluoro-N-methyl-N-(3-methylbutyl)-3-sulfamoylbenzamide
CID 65388013
2,5-difluoro-N-methyl-N-(2-methylbutyl)-3-sulfamoylbenzamide
CID 65387583
5-fluoro-2-methyl-3-sulfamoyl-N-(2,2,2-trifluoroethyl)benzamide
CID 65373702

Frequently Asked Questions

What is the IUPAC name of 2,5-difluoro-N-methyl-3-sulfamoylbenzamide?
The IUPAC name of 2,5-difluoro-N-methyl-3-sulfamoylbenzamide (CID 65373274) is 2,5-difluoro-N-methyl-3-sulfamoylbenzamide.
What is the SMILES notation for 2,5-difluoro-N-methyl-3-sulfamoylbenzamide?
The canonical SMILES for 2,5-difluoro-N-methyl-3-sulfamoylbenzamide is CNC(=O)c1cc(F)cc(S(N)(=O)=O)c1F.
What is the InChIKey of 2,5-difluoro-N-methyl-3-sulfamoylbenzamide?
The InChIKey is FMCFGKGSRPNZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O3S/c1-12-8(13)5-2-4(9)3-6(7(5)10)16(11,14)15/h2-3H,1H3,(H,12,13)(H2,11,14,15).
What are the key properties of 2,5-difluoro-N-methyl-3-sulfamoylbenzamide?
2,5-difluoro-N-methyl-3-sulfamoylbenzamide has a molecular weight of 250.23 g/mol, XLogP of -0.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-difluoro-N-methyl-3-sulfamoylbenzamide is sourced from PubChem (CID 65373274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).