N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide

C11H13FN2O3S — CID 81479218

IUPACN-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide
SMILESCc1cc(S(N)(=O)=O)cc(C(=O)NC2CC2)c1F
InChIInChI=1S/C11H13FN2O3S/c1-6-4-8(18(13,16)17)5-9(10(6)12)11(15)14-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyLNGNNKRTELISIA-UHFFFAOYSA-N
MW272.30 g/mol
LogP0.67
Rot. Bonds3

About N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide

N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide (PubChem CID 81479218) has the molecular formula C11H13FN2O3S and a molecular weight of 272.30 g/mol. Its IUPAC name is N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide
PubChem CID81479218
Molecular FormulaC11H13FN2O3S
Molecular Weight272.30 g/mol
Exact Mass272.06
IUPAC NameN-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide
SMILESCc1cc(S(N)(=O)=O)cc(C(=O)NC2CC2)c1F
InChIInChI=1S/C11H13FN2O3S/c1-6-4-8(18(13,16)17)5-9(10(6)12)11(15)14-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyLNGNNKRTELISIA-UHFFFAOYSA-N
XLogP0.67
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-fluoro-3-methyl-N-propan-2-yl-5-sulfamoylbenzamide
CID 81478779
N-(3,3-dimethylbutan-2-yl)-2-fluoro-3-methyl-5-sulfamoylbenzamide
CID 104830380
2-bromo-1-N-cyclopropyl-3-N-[(1S,2R)-2-fluorocyclopropyl]-5-sulfamoylbenzene-1,3-dicarboxamide
CID 154726888
2-fluoro-3-methyl-N-pentan-2-yl-5-sulfamoylbenzamide
CID 81478345
3-bromo-N-cyclopropyl-2-fluoro-5-methylbenzamide
CID 165436206
methyl 4-[(2-methyl-5-sulfamoylbenzoyl)amino]piperidine-1-carboxylate
CID 47072778
3-(2-azabicyclo[2.2.1]heptane-2-carbonyl)-4-fluoro-5-methylbenzenesulfonamide
CID 81481834
N-cyclopropyl-2-fluoro-5-nitro-3-sulfamoylbenzamide
CID 65374989
2-fluoro-3-methyl-N-(4-methylcyclohexyl)-5-nitrobenzamide
CID 103297073
N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide
CID 47469038
N-[(1S,2R)-2-aminocyclobutyl]-2-methyl-5-sulfamoylbenzamide
CID 56884915
N-cyclobutyl-2-fluoro-5-hydroxy-4-methylbenzamide
CID 171906052

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide?
The IUPAC name of N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide (CID 81479218) is N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide.
What is the SMILES notation for N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide?
The canonical SMILES for N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide is Cc1cc(S(N)(=O)=O)cc(C(=O)NC2CC2)c1F.
What is the InChIKey of N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide?
The InChIKey is LNGNNKRTELISIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O3S/c1-6-4-8(18(13,16)17)5-9(10(6)12)11(15)14-7-2-3-7/h4-5,7H,2-3H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide?
N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide has a molecular weight of 272.30 g/mol, XLogP of 0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-fluoro-3-methyl-5-sulfamoylbenzamide is sourced from PubChem (CID 81479218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).