3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide

C17H27N3O3S — CID 120556196

IUPAC3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)NC2CCNCC2C)c1
InChIInChI=1S/C17H27N3O3S/c1-4-20(5-2)24(22,23)15-8-6-7-14(11-15)17(21)19-16-9-10-18-12-13(16)3/h6-8,11,13,16,18H,4-5,9-10,12H2,1-3H3,(H,19,21)
InChIKeyOUHUHYYUPUCESL-UHFFFAOYSA-N
MW353.49 g/mol
LogP1.44
Rot. Bonds6

About 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide

3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide (PubChem CID 120556196) has the molecular formula C17H27N3O3S and a molecular weight of 353.49 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide
PubChem CID120556196
Molecular FormulaC17H27N3O3S
Molecular Weight353.49 g/mol
Exact Mass353.18
IUPAC Name3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1cccc(C(=O)NC2CCNCC2C)c1
InChIInChI=1S/C17H27N3O3S/c1-4-20(5-2)24(22,23)15-8-6-7-14(11-15)17(21)19-16-9-10-18-12-13(16)3/h6-8,11,13,16,18H,4-5,9-10,12H2,1-3H3,(H,19,21)
InChIKeyOUHUHYYUPUCESL-UHFFFAOYSA-N
XLogP1.44
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2-fluorophenyl)sulfamoyl]-N-(3-methylpiperidin-4-yl)benzamide
CID 120554339
N-(3-methylpiperidin-4-yl)-3-(trifluoromethyl)benzamide
CID 79886276
3-N-(3-methylpiperidin-4-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 120555486
N-(3-methylpiperidin-4-yl)-3-(propanoylamino)benzamide
CID 120554475
3-(diethylsulfamoyl)-N-(2-oxopiperidin-3-yl)benzamide
CID 51128604
N-[2-(aminomethyl)cyclohexyl]-3-(diethylsulfamoyl)benzamide;hydrochloride
CID 119610921
3-[ethyl(phenyl)sulfamoyl]-N-piperidin-3-ylbenzamide
CID 119425491
3-(diethylsulfamoyl)-N-methylbenzamide
CID 47099917
N-(3-methylpiperidin-4-yl)-3-[3-(trifluoromethyl)pyrazol-1-yl]benzamide
CID 120557791
N-cyclopropyl-3-[2,2-difluoroethyl(ethyl)sulfamoyl]benzamide
CID 146089268
3-(3-methoxypropoxy)-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120555078
4-[(ethylsulfonylamino)methyl]-N-(3-methylpiperidin-4-yl)benzamide
CID 120557775

Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide?
The IUPAC name of 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide (CID 120556196) is 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide.
What is the SMILES notation for 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide?
The canonical SMILES for 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide is CCN(CC)S(=O)(=O)c1cccc(C(=O)NC2CCNCC2C)c1.
What is the InChIKey of 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide?
The InChIKey is OUHUHYYUPUCESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3S/c1-4-20(5-2)24(22,23)15-8-6-7-14(11-15)17(21)19-16-9-10-18-12-13(16)3/h6-8,11,13,16,18H,4-5,9-10,12H2,1-3H3,(H,19,21).
What are the key properties of 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide?
3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide has a molecular weight of 353.49 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-N-(3-methylpiperidin-4-yl)benzamide is sourced from PubChem (CID 120556196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).