5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride

C20H26ClN3O3S — CID 119388373

IUPAC5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NC1CCNCC1.Cl
InChIInChI=1S/C20H25N3O3S.ClH/c1-15-7-8-18(27(25,26)22-14-16-5-3-2-4-6-16)13-19(15)20(24)23-17-9-11-21-12-10-17;/h2-8,13,17,21-22H,9-12,14H2,1H3,(H,23,24);1H
InChIKeyCCOGETMCRWKAKT-UHFFFAOYSA-N
MW423.97 g/mol
LogP2.38
Rot. Bonds6

About 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride

5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 119388373) has the molecular formula C20H26ClN3O3S and a molecular weight of 423.97 g/mol. Its IUPAC name is 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride
PubChem CID119388373
Molecular FormulaC20H26ClN3O3S
Molecular Weight423.97 g/mol
Exact Mass423.14
IUPAC Name5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NC1CCNCC1.Cl
InChIInChI=1S/C20H25N3O3S.ClH/c1-15-7-8-18(27(25,26)22-14-16-5-3-2-4-6-16)13-19(15)20(24)23-17-9-11-21-12-10-17;/h2-8,13,17,21-22H,9-12,14H2,1H3,(H,23,24);1H
InChIKeyCCOGETMCRWKAKT-UHFFFAOYSA-N
XLogP2.38
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.97
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 31514219
5-(benzylsulfamoyl)-2-methyl-N-[3-(methylamino)propyl]benzamide;hydrochloride
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5-[(4-fluorophenyl)sulfamoyl]-2-methyl-N-piperidin-4-ylbenzamide
CID 119386331
5-(benzylsulfamoyl)-N-(2-chlorophenyl)-2-methylbenzamide
CID 30281742
3-(4-aminopiperidine-1-carbonyl)-N-benzyl-4-methylbenzenesulfonamide;hydrochloride
CID 119375100
N-(1-adamantyl)-5-(benzylsulfamoyl)-2-methylbenzamide
CID 43008919
5-(benzylsulfamoyl)-2-methyl-N-prop-2-enylbenzamide
CID 35154379
5-(benzylsulfamoyl)-2-methyl-N-(2,2,2-trifluoroethyl)benzamide
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3-(benzylsulfamoyl)-N-cyclopropylbenzamide
CID 9165600

Frequently Asked Questions

What is the IUPAC name of 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride (CID 119388373) is 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride is Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NC1CCNCC1.Cl.
What is the InChIKey of 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is CCOGETMCRWKAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3S.ClH/c1-15-7-8-18(27(25,26)22-14-16-5-3-2-4-6-16)13-19(15)20(24)23-17-9-11-21-12-10-17;/h2-8,13,17,21-22H,9-12,14H2,1H3,(H,23,24);1H.
What are the key properties of 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride?
5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 423.97 g/mol, XLogP of 2.38, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzylsulfamoyl)-2-methyl-N-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 119388373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).