4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide

C19H24N2O4S — CID 55860503

IUPAC4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide
SMILESCCOc1ccccc1CN(C)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C19H24N2O4S/c1-5-25-18-9-7-6-8-16(18)14-21(4)19(22)15-10-12-17(13-11-15)26(23,24)20(2)3/h6-13H,5,14H2,1-4H3
InChIKeyXFUQSWDGMFGQGC-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.61
Rot. Bonds7

About 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide

4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide (PubChem CID 55860503) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide
PubChem CID55860503
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide
SMILESCCOc1ccccc1CN(C)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C19H24N2O4S/c1-5-25-18-9-7-6-8-16(18)14-21(4)19(22)15-10-12-17(13-11-15)26(23,24)20(2)3/h6-13H,5,14H2,1-4H3
InChIKeyXFUQSWDGMFGQGC-UHFFFAOYSA-N
XLogP2.61
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-ethoxyphenyl)methyl 4-(dimethylsulfamoyl)benzoate
CID 2603742
2-[benzenesulfonyl(methyl)amino]-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 55957400
N-[(2-ethoxyphenyl)methyl]-N-ethyl-4-methylsulfonylbenzamide
CID 46987200
N-[(2-ethoxyphenyl)methyl]-3-iodo-N-methylbenzamide
CID 61026834
4-(dimethylsulfamoyl)-N-[2-(2-propylphenoxy)ethyl]benzamide
CID 38113944
N-[(2-ethoxyphenyl)methyl]-N,4-dimethylbenzenesulfonamide
CID 26003303
3-bromo-N-[(2-ethoxyphenyl)methyl]-5-fluoro-N-methylbenzamide
CID 55861656
N-[4-[(2-ethoxyphenyl)methyl-methylsulfamoyl]phenyl]acetamide
CID 94606005
3-(tert-butylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-4-methoxy-N-methylbenzamide
CID 55861150
2-bromo-N-[(2-ethoxyphenyl)methyl]-N-methylacetamide
CID 63678589
4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 28635128
3-(dimethylsulfamoyl)-N-methyl-N-[[2-(trifluoromethoxy)phenyl]methyl]benzamide
CID 38072733

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide (CID 55860503) is 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide is CCOc1ccccc1CN(C)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide?
The InChIKey is XFUQSWDGMFGQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-25-18-9-7-6-8-16(18)14-21(4)19(22)15-10-12-17(13-11-15)26(23,24)20(2)3/h6-13H,5,14H2,1-4H3.
What are the key properties of 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide?
4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide has a molecular weight of 376.48 g/mol, XLogP of 2.61, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-[(2-ethoxyphenyl)methyl]-N-methylbenzamide is sourced from PubChem (CID 55860503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).