3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide

C17H20N2O5S — CID 55565688

IUPAC3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide
SMILESCOCCNS(=O)(=O)c1cccc(C(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C17H20N2O5S/c1-23-10-9-18-25(21,22)16-8-3-5-13(11-16)17(20)19-14-6-4-7-15(12-14)24-2/h3-8,11-12,18H,9-10H2,1-2H3,(H,19,20)
InChIKeySUDLLXDSONCVHN-UHFFFAOYSA-N
MW364.42 g/mol
LogP1.87
Rot. Bonds8

About 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide

3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide (PubChem CID 55565688) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide
PubChem CID55565688
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC Name3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide
SMILESCOCCNS(=O)(=O)c1cccc(C(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C17H20N2O5S/c1-23-10-9-18-25(21,22)16-8-3-5-13(11-16)17(20)19-14-6-4-7-15(12-14)24-2/h3-8,11-12,18H,9-10H2,1-2H3,(H,19,20)
InChIKeySUDLLXDSONCVHN-UHFFFAOYSA-N
XLogP1.87
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methoxyethylsulfamoyl)-N-phenylbenzamide
CID 6463975
N-(3-methoxyphenyl)-3-(3-methylbutylsulfamoyl)benzamide
CID 109065294
N-(2,4-dimethoxyphenyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063596
N-[4-(dimethylamino)phenyl]-3-(2-methoxyethylsulfamoyl)benzamide
CID 109063603
N-(4-methoxyphenyl)-3-(propylsulfamoyl)benzamide
CID 109061946
N-(2-methoxyethyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 55565687
N-(3-methoxyphenyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 27167566
N-(3-methoxyphenyl)-3-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 43001593
methyl 3-[[3-(propylsulfamoyl)benzoyl]amino]benzoate
CID 109061963
N-(3-methoxyphenyl)-4-(pentylsulfamoyl)benzamide
CID 109061401
3-(benzenesulfonamido)-N-(3-methoxyphenyl)benzamide
CID 7541945
3-(carbamoylamino)-N-(3-methoxyphenyl)benzamide
CID 29199856

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide (CID 55565688) is 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide is COCCNS(=O)(=O)c1cccc(C(=O)Nc2cccc(OC)c2)c1.
What is the InChIKey of 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide?
The InChIKey is SUDLLXDSONCVHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-23-10-9-18-25(21,22)16-8-3-5-13(11-16)17(20)19-14-6-4-7-15(12-14)24-2/h3-8,11-12,18H,9-10H2,1-2H3,(H,19,20).
What are the key properties of 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide?
3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide has a molecular weight of 364.42 g/mol, XLogP of 1.87, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethylsulfamoyl)-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 55565688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).