3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide

C17H15N3O5S — CID 2379537

IUPAC3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc3c2C(=O)NC3=O)c1
InChIInChI=1S/C17H15N3O5S/c1-20(2)26(24,25)11-6-3-5-10(9-11)15(21)18-13-8-4-7-12-14(13)17(23)19-16(12)22/h3-9H,1-2H3,(H,18,21)(H,19,22,23)
InChIKeyYAIDZHINNREXAB-UHFFFAOYSA-N
MW373.39 g/mol
LogP1.07
Rot. Bonds4

About 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide

3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide (PubChem CID 2379537) has the molecular formula C17H15N3O5S and a molecular weight of 373.39 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide
PubChem CID2379537
Molecular FormulaC17H15N3O5S
Molecular Weight373.39 g/mol
Exact Mass373.07
IUPAC Name3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc3c2C(=O)NC3=O)c1
InChIInChI=1S/C17H15N3O5S/c1-20(2)26(24,25)11-6-3-5-10(9-11)15(21)18-13-8-4-7-12-14(13)17(23)19-16(12)22/h3-9H,1-2H3,(H,18,21)(H,19,22,23)
InChIKeyYAIDZHINNREXAB-UHFFFAOYSA-N
XLogP1.07
TPSA112.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide 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

3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 2221549
4-(dimethylsulfamoyl)-N-[2-[(1,3-dioxoisoindol-4-yl)amino]-2-oxoethanethioyl]benzamide
CID 3267938
N-(5-chloro-2-fluorophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2664609
N-[2-(2-amino-2-oxoethyl)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 55603942
3-(dimethylsulfamoyl)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 55341476
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591093
N-benzyl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 100624742
N-butan-2-yl-2-[[3-(dimethylsulfamoyl)benzoyl]amino]benzamide
CID 133231331
3-(dimethylsulfamoyl)-N-(2-piperidin-1-ylphenyl)benzamide
CID 2426815
2-[[3-(dimethylsulfamoyl)benzoyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 95295267
N-[4-(dimethylamino)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 110356126
N-(2,5-dimethoxyphenyl)-3-(dimethylsulfamoyl)benzamide
CID 2083463

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide (CID 2379537) is 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2cccc3c2C(=O)NC3=O)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide?
The InChIKey is YAIDZHINNREXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O5S/c1-20(2)26(24,25)11-6-3-5-10(9-11)15(21)18-13-8-4-7-12-14(13)17(23)19-16(12)22/h3-9H,1-2H3,(H,18,21)(H,19,22,23).
What are the key properties of 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide?
3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide has a molecular weight of 373.39 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(1,3-dioxoisoindol-4-yl)benzamide is sourced from PubChem (CID 2379537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).