4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide

C17H20N2O4S — CID 2713344

IUPAC4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide
SMILESCOc1ccccc1CNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C17H20N2O4S/c1-19(2)24(21,22)15-10-8-13(9-11-15)17(20)18-12-14-6-4-5-7-16(14)23-3/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyWUYCREQUAMASJX-UHFFFAOYSA-N
MW348.42 g/mol
LogP1.88
Rot. Bonds6

About 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide

4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide (PubChem CID 2713344) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide
PubChem CID2713344
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide
SMILESCOc1ccccc1CNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C17H20N2O4S/c1-19(2)24(21,22)15-10-8-13(9-11-15)17(20)18-12-14-6-4-5-7-16(14)23-3/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyWUYCREQUAMASJX-UHFFFAOYSA-N
XLogP1.88
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide (CID 2713344) is 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide is COc1ccccc1CNC(=O)c1ccc(S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide?
The InChIKey is WUYCREQUAMASJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-19(2)24(21,22)15-10-8-13(9-11-15)17(20)18-12-14-6-4-5-7-16(14)23-3/h4-11H,12H2,1-3H3,(H,18,20).
What are the key properties of 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide?
4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide has a molecular weight of 348.42 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[(2-methoxyphenyl)methyl]benzamide is sourced from PubChem (CID 2713344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).