4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide

C16H26N4O3S — CID 53278389

IUPAC4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
SMILESCN1CCC(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)CC1
InChIInChI=1S/C16H26N4O3S/c1-18(2)24(22,23)20(4)15-7-5-13(6-8-15)16(21)17-14-9-11-19(3)12-10-14/h5-8,14H,9-12H2,1-4H3,(H,17,21)
InChIKeyWKZDTPDXJBAJET-UHFFFAOYSA-N
MW354.48 g/mol
LogP0.75
Rot. Bonds5

About 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide

4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide (PubChem CID 53278389) has the molecular formula C16H26N4O3S and a molecular weight of 354.48 g/mol. Its IUPAC name is 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
PubChem CID53278389
Molecular FormulaC16H26N4O3S
Molecular Weight354.48 g/mol
Exact Mass354.17
IUPAC Name4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
SMILESCN1CCC(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)CC1
InChIInChI=1S/C16H26N4O3S/c1-18(2)24(22,23)20(4)15-7-5-13(6-8-15)16(21)17-14-9-11-19(3)12-10-14/h5-8,14H,9-12H2,1-4H3,(H,17,21)
InChIKeyWKZDTPDXJBAJET-UHFFFAOYSA-N
XLogP0.75
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[methyl-(4-methylphenyl)sulfonylamino]-N-(1-methylpiperidin-4-yl)benzamide
CID 53279690
4-[ethyl(ethylsulfonyl)amino]-N-(1-methylpiperidin-4-yl)benzamide
CID 50945980
4-[dimethylsulfamoyl(methyl)amino]-N-[4-(1-methylpiperidin-4-yl)oxyphenyl]benzamide
CID 53278475
N-(1-methylpiperidin-4-yl)-4-[methylsulfonyl(prop-2-enyl)amino]benzamide
CID 53280013
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
4-carbamothioyl-N-(1-methylpiperidin-4-yl)benzamide
CID 43373646
[4-[(1-methylpiperidin-4-yl)carbamoyl]phenyl]boronic acid
CID 140843225
4-acetamido-N-(1-methylpiperidin-4-yl)benzamide
CID 47114509
4-[(3,4-dimethyl-N-methylsulfonylanilino)methyl]-N-(1-methylpiperidin-4-yl)benzamide
CID 53278671
4-[(2-chlorophenyl)methyl-methylsulfonylamino]-N-(1-methylpiperidin-4-yl)benzamide
CID 56700074
4-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-N-(1-methylpiperidin-4-yl)benzamide
CID 53278728
3-(methanesulfonamido)-4-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 53281831

Frequently Asked Questions

What is the IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
The IUPAC name of 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide (CID 53278389) is 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide.
What is the SMILES notation for 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
The canonical SMILES for 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide is CN1CCC(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)CC1.
What is the InChIKey of 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
The InChIKey is WKZDTPDXJBAJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O3S/c1-18(2)24(22,23)20(4)15-7-5-13(6-8-15)16(21)17-14-9-11-19(3)12-10-14/h5-8,14H,9-12H2,1-4H3,(H,17,21).
What are the key properties of 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide?
4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide has a molecular weight of 354.48 g/mol, XLogP of 0.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dimethylsulfamoyl(methyl)amino]-N-(1-methylpiperidin-4-yl)benzamide is sourced from PubChem (CID 53278389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).