1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide

C13H27N3O3S — CID 131955942

IUPAC1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
SMILESCC(C)C(C)NC(=O)C1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C13H27N3O3S/c1-10(2)11(3)14-13(17)12-6-8-16(9-7-12)20(18,19)15(4)5/h10-12H,6-9H2,1-5H3,(H,14,17)
InChIKeyPJVDRUBOKZTLQT-UHFFFAOYSA-N
MW305.44 g/mol
LogP0.67
Rot. Bonds5

About 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide

1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide (PubChem CID 131955942) has the molecular formula C13H27N3O3S and a molecular weight of 305.44 g/mol. Its IUPAC name is 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
PubChem CID131955942
Molecular FormulaC13H27N3O3S
Molecular Weight305.44 g/mol
Exact Mass305.18
IUPAC Name1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide
SMILESCC(C)C(C)NC(=O)C1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C13H27N3O3S/c1-10(2)11(3)14-13(17)12-6-8-16(9-7-12)20(18,19)15(4)5/h10-12H,6-9H2,1-5H3,(H,14,17)
InChIKeyPJVDRUBOKZTLQT-UHFFFAOYSA-N
XLogP0.67
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.44
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-1-(dimethylsulfamoyl)-N-[(2S)-3-methylbutan-2-yl]piperidine-3-carboxamide
CID 125074634
1-(4-fluorophenyl)sulfonyl-N-[(2R)-3-methylbutan-2-yl]piperidine-4-carboxamide
CID 26202360
1-(4-fluorophenyl)sulfonyl-N-[(2S)-3-methylbutan-2-yl]piperidine-4-carboxamide
CID 26202361
N-butan-2-yl-1-(diethylsulfamoyl)piperidine-4-carboxamide
CID 4136250
1-(dimethylsulfamoyl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
CID 56921668
N-[(2S)-3-methylbutan-2-yl]-1-[(4-methylphenyl)methylsulfonyl]piperidine-4-carboxamide
CID 100568345
N-[(2S)-3-methylbutan-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 27511485
N-(3-methylbutan-2-yl)-1-(3-methylphenyl)sulfonylpiperidine-4-carboxamide
CID 47090100
N-(1-adamantyl)-1-(dimethylsulfamoyl)piperidine-4-carboxamide
CID 41466824
1-[(4-chlorophenyl)methylsulfonyl]-N-[(2S)-3-methylbutan-2-yl]piperidine-4-carboxamide
CID 100568439
N-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]-1-(dimethylsulfamoyl)piperidine-4-carboxamide
CID 98112728
1-[butyl(methyl)sulfamoyl]-N-ethylpiperidine-4-carboxamide
CID 86931198

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide (CID 131955942) is 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide is CC(C)C(C)NC(=O)C1CCN(S(=O)(=O)N(C)C)CC1.
What is the InChIKey of 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide?
The InChIKey is PJVDRUBOKZTLQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O3S/c1-10(2)11(3)14-13(17)12-6-8-16(9-7-12)20(18,19)15(4)5/h10-12H,6-9H2,1-5H3,(H,14,17).
What are the key properties of 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide?
1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide has a molecular weight of 305.44 g/mol, XLogP of 0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoyl)-N-(3-methylbutan-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 131955942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).