3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide

C19H24N4O3S — CID 110249555

IUPAC3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide
SMILESCN(C)S(=O)(=O)N1CCCC(c2cccc(-c3cccc(C(N)=O)c3)n2)C1
InChIInChI=1S/C19H24N4O3S/c1-22(2)27(25,26)23-11-5-8-16(13-23)18-10-4-9-17(21-18)14-6-3-7-15(12-14)19(20)24/h3-4,6-7,9-10,12,16H,5,8,11,13H2,1-2H3,(H2,20,24)
InChIKeyNOZZHILYFQHWBI-UHFFFAOYSA-N
MW388.49 g/mol
LogP1.83
Rot. Bonds5

About 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide

3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide (PubChem CID 110249555) has the molecular formula C19H24N4O3S and a molecular weight of 388.49 g/mol. Its IUPAC name is 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide
PubChem CID110249555
Molecular FormulaC19H24N4O3S
Molecular Weight388.49 g/mol
Exact Mass388.16
IUPAC Name3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide
SMILESCN(C)S(=O)(=O)N1CCCC(c2cccc(-c3cccc(C(N)=O)c3)n2)C1
InChIInChI=1S/C19H24N4O3S/c1-22(2)27(25,26)23-11-5-8-16(13-23)18-10-4-9-17(21-18)14-6-3-7-15(12-14)19(20)24/h3-4,6-7,9-10,12,16H,5,8,11,13H2,1-2H3,(H2,20,24)
InChIKeyNOZZHILYFQHWBI-UHFFFAOYSA-N
XLogP1.83
TPSA96.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-[(3R)-1-(dimethylsulfamoyl)piperidin-3-yl]pyrazin-2-yl]benzamide
CID 95819022
3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]pyrazin-2-yl]benzoic acid
CID 110120298
3-[6-[(3S)-1-(4-fluorophenyl)sulfonylpiperidin-3-yl]-2-pyridinyl]benzamide
CID 95809420
3-[6-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-3-yl]-2-pyridinyl]benzamide
CID 110249975
3-[6-[(3S)-1-(1-methylpiperidine-4-carbonyl)piperidin-3-yl]-2-pyridinyl]benzamide
CID 95810732
5-[6-[(3S)-1-(dimethylsulfamoyl)piperidin-3-yl]pyrazin-2-yl]pyridine-3-carboxylic acid
CID 124940879
3-[6-[1-(4-methyl-1,3-thiazole-5-carbonyl)piperidin-3-yl]-2-pyridinyl]benzamide
CID 110249773
3-[6-[(3S)-1-[2-(4-fluorophenyl)acetyl]piperidin-3-yl]-2-pyridinyl]benzamide
CID 95809940
2-(3-fluorophenyl)-6-(1-methylsulfonylpiperidin-3-yl)pyridine
CID 110249421
(3S)-3-[6-[(4,6-dimethylpyrimidin-2-yl)amino]-2-pyridinyl]-N,N-dimethylpiperidine-1-sulfonamide
CID 95835947
3-[6-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-pyridinyl]-N,N-dimethylpiperidine-1-sulfonamide
CID 155987031
(3S)-N,N-dimethyl-3-[6-[(3-methylphenyl)methyl]-2-pyridinyl]piperidine-1-sulfonamide
CID 95809648

Frequently Asked Questions

What is the IUPAC name of 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide?
The IUPAC name of 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide (CID 110249555) is 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide.
What is the SMILES notation for 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide?
The canonical SMILES for 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide is CN(C)S(=O)(=O)N1CCCC(c2cccc(-c3cccc(C(N)=O)c3)n2)C1.
What is the InChIKey of 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide?
The InChIKey is NOZZHILYFQHWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3S/c1-22(2)27(25,26)23-11-5-8-16(13-23)18-10-4-9-17(21-18)14-6-3-7-15(12-14)19(20)24/h3-4,6-7,9-10,12,16H,5,8,11,13H2,1-2H3,(H2,20,24).
What are the key properties of 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide?
3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide has a molecular weight of 388.49 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[1-(dimethylsulfamoyl)piperidin-3-yl]-2-pyridinyl]benzamide is sourced from PubChem (CID 110249555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).