N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide

C10H13FN2O3S2 — CID 61132513

IUPACN-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide
SMILESCSCCC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1
InChIInChI=1S/C10H13FN2O3S2/c1-17-3-2-10(14)13-8-4-7(11)5-9(6-8)18(12,15)16/h4-6H,2-3H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyLHGKFVMLBVCVMK-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.16
Rot. Bonds5

About N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide

N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide (PubChem CID 61132513) has the molecular formula C10H13FN2O3S2 and a molecular weight of 292.36 g/mol. Its IUPAC name is N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide.

Molecular Properties

Compound NameN-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide
PubChem CID61132513
Molecular FormulaC10H13FN2O3S2
Molecular Weight292.36 g/mol
Exact Mass292.04
IUPAC NameN-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide
SMILESCSCCC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1
InChIInChI=1S/C10H13FN2O3S2/c1-17-3-2-10(14)13-8-4-7(11)5-9(6-8)18(12,15)16/h4-6H,2-3H2,1H3,(H,13,14)(H2,12,15,16)
InChIKeyLHGKFVMLBVCVMK-UHFFFAOYSA-N
XLogP1.16
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide 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-(3-fluoro-5-sulfamoylphenyl)pentanamide
CID 61132325
3,3,3-trifluoro-N-(3-fluoro-5-sulfamoylphenyl)propanamide
CID 61132230
N-(2-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide
CID 61129999
1-(3-fluoro-5-sulfamoylphenyl)-3-methylurea
CID 78993821
N-(3-fluoro-5-sulfamoylphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 61132417
2-[(3-chlorophenyl)methylsulfanyl]-N-(3-fluoro-5-sulfamoylphenyl)acetamide
CID 55980561
N-(3,5-difluorophenyl)butanamide
CID 17271988
N-(3-fluoro-5-sulfamoylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 63362226
2-chloro-N-(3-fluoro-5-sulfamoylphenyl)benzamide
CID 61132724
N-(3-fluoro-5-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
CID 51975647
2,5-dichloro-N-(3-fluoro-5-sulfamoylphenyl)thiophene-3-carboxamide
CID 103727937
1-(2,2-dimethylpropanoyl)-N-(3-fluoro-5-sulfamoylphenyl)piperidine-4-carboxamide
CID 55979660

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide?
The IUPAC name of N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide (CID 61132513) is N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide.
What is the SMILES notation for N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide?
The canonical SMILES for N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide is CSCCC(=O)Nc1cc(F)cc(S(N)(=O)=O)c1.
What is the InChIKey of N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide?
The InChIKey is LHGKFVMLBVCVMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O3S2/c1-17-3-2-10(14)13-8-4-7(11)5-9(6-8)18(12,15)16/h4-6H,2-3H2,1H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide?
N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide has a molecular weight of 292.36 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-5-sulfamoylphenyl)-3-methylsulfanylpropanamide is sourced from PubChem (CID 61132513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).