N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide

C11H13FN2O5S — CID 62803145

IUPACN-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide
SMILESNS(=O)(=O)c1ccc(F)c(NC(=O)C2COCCO2)c1
InChIInChI=1S/C11H13FN2O5S/c12-8-2-1-7(20(13,16)17)5-9(8)14-11(15)10-6-18-3-4-19-10/h1-2,5,10H,3-4,6H2,(H,14,15)(H2,13,16,17)
InChIKeyOWKMVFWALMKJTA-UHFFFAOYSA-N
MW304.30 g/mol
LogP-0.17
Rot. Bonds3

About N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide

N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide (PubChem CID 62803145) has the molecular formula C11H13FN2O5S and a molecular weight of 304.30 g/mol. Its IUPAC name is N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide
PubChem CID62803145
Molecular FormulaC11H13FN2O5S
Molecular Weight304.30 g/mol
Exact Mass304.05
IUPAC NameN-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide
SMILESNS(=O)(=O)c1ccc(F)c(NC(=O)C2COCCO2)c1
InChIInChI=1S/C11H13FN2O5S/c12-8-2-1-7(20(13,16)17)5-9(8)14-11(15)10-6-18-3-4-19-10/h1-2,5,10H,3-4,6H2,(H,14,15)(H2,13,16,17)
InChIKeyOWKMVFWALMKJTA-UHFFFAOYSA-N
XLogP-0.17
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.30
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide 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

N-(2-fluoro-5-sulfamoylphenyl)cyclopropanecarboxamide
CID 61130725
N-(2-fluoro-5-sulfamoylphenyl)-2-methyloxolane-3-carboxamide
CID 79762826
N-(2-fluoro-5-sulfamoylphenyl)cyclopentanecarboxamide
CID 61129788
N-(2-fluoro-5-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66476009
3-chloro-4-(1,4-dioxane-2-carbonylamino)benzenesulfonyl chloride
CID 62799378
(2S)-N-[3-(cyclohexanecarbonylamino)-4-fluorophenyl]-1,4-dioxane-2-carboxamide
CID 94130346
1-cyclobutyl-3-(2-fluoro-5-sulfamoylphenyl)urea
CID 116658850
N-(2-fluoro-5-sulfamoylphenyl)-2,2-dimethylpropanamide
CID 61129967
N-(2-fluoro-5-sulfamoylphenyl)-2-methylcyclopentane-1-carboxamide
CID 107182876
2-(1,4-dioxane-2-carbonylamino)-5-fluorobenzoic acid
CID 43359644
N-(3-methyl-4-sulfamoylphenyl)-1,4-dioxane-2-carboxamide
CID 62805272
N-(2-cyano-4-fluorophenyl)-1,4-dioxane-2-carboxamide
CID 79954692

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide?
The IUPAC name of N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide (CID 62803145) is N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide?
The canonical SMILES for N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide is NS(=O)(=O)c1ccc(F)c(NC(=O)C2COCCO2)c1.
What is the InChIKey of N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide?
The InChIKey is OWKMVFWALMKJTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O5S/c12-8-2-1-7(20(13,16)17)5-9(8)14-11(15)10-6-18-3-4-19-10/h1-2,5,10H,3-4,6H2,(H,14,15)(H2,13,16,17).
What are the key properties of N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide?
N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide has a molecular weight of 304.30 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-sulfamoylphenyl)-1,4-dioxane-2-carboxamide is sourced from PubChem (CID 62803145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).