4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide

C17H20N2O4S — CID 3959794

IUPAC4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide
SMILESCCOc1cccc(NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1
InChIInChI=1S/C17H20N2O4S/c1-4-23-15-7-5-6-14(12-15)18-17(20)13-8-10-16(11-9-13)24(21,22)19(2)3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyUBUPQHUMFDPNQQ-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.59
Rot. Bonds6

About 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide

4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide (PubChem CID 3959794) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide
PubChem CID3959794
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide
SMILESCCOc1cccc(NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1
InChIInChI=1S/C17H20N2O4S/c1-4-23-15-7-5-6-14(12-15)18-17(20)13-8-10-16(11-9-13)24(21,22)19(2)3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyUBUPQHUMFDPNQQ-UHFFFAOYSA-N
XLogP2.59
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 ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Mepronil
CID 41632
N-(2-methoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2083341
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-piperidinylsulfonyl)benzamide
CID 1262699
N-(2-methoxy-5-{[(tetrahydro-2-furanylmethyl)amino]sulfonyl}phenyl)benzamide
CID 2987883
[2-[[4-[(4-Sulfamoylphenyl)methylselanyl]phenyl]carbamoyl]phenyl] acetate
CID 145956803
N-(3,5-dimethoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2116569
4-[(2-methoxyphenyl)sulfamoyl]-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 2519306
N1-{3-[3-(acetylamino)phenoxy]propyl}-4-(tert-butyl)benzamide
CID 2802629
N1-[3-(3-{[(4-cyanophenyl)sulfonyl]amino}propoxy)phenyl]acetamide
CID 2802630
4-[ethyl(phenyl)sulfamoyl]-N-(furan-2-ylmethyl)benzamide
CID 3314293
N-(3,5-dimethoxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 3900901
4-(azepane-1-carbonyl)-N-(4-methoxyphenyl)benzenesulfonamide
CID 4789238

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide (CID 3959794) is 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide is CCOc1cccc(NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide?
The InChIKey is UBUPQHUMFDPNQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-4-23-15-7-5-6-14(12-15)18-17(20)13-8-10-16(11-9-13)24(21,22)19(2)3/h5-12H,4H2,1-3H3,(H,18,20).
What are the key properties of 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide?
4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(3-ethoxyphenyl)benzamide is sourced from PubChem (CID 3959794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).