2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide

C11H22N2O3S — CID 114815335

IUPAC2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide
SMILESCC(=O)C1CCCCN1S(=O)(=O)NCC(C)C
InChIInChI=1S/C11H22N2O3S/c1-9(2)8-12-17(15,16)13-7-5-4-6-11(13)10(3)14/h9,11-12H,4-8H2,1-3H3
InChIKeyHTOQNJRBOMOXCY-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.92
Rot. Bonds5

About 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide

2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide (PubChem CID 114815335) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide
PubChem CID114815335
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide
SMILESCC(=O)C1CCCCN1S(=O)(=O)NCC(C)C
InChIInChI=1S/C11H22N2O3S/c1-9(2)8-12-17(15,16)13-7-5-4-6-11(13)10(3)14/h9,11-12H,4-8H2,1-3H3
InChIKeyHTOQNJRBOMOXCY-UHFFFAOYSA-N
XLogP0.92
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 1-(2-methylpropylsulfamoyl)piperidine-2-carboxylate
CID 114816360
N-(2-methylpropyl)-2-(2-oxopropyl)pyrrolidine-1-sulfonamide
CID 114815362
1-(2,3,3-trimethylbutylsulfamoyl)piperidine-2-carboxylic acid
CID 83141758
2-[(tert-butylamino)methyl]-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 114816832
1-(2,2-diethoxyethylsulfamoyl)piperidine-2-carboxylic acid
CID 79538538
1-[(2-hydroxy-4,4-dimethylpentyl)sulfamoyl]piperidine-2-carboxylic acid
CID 107151259
1-[1-(difluoromethylsulfonyl)piperidin-2-yl]ethanone
CID 63844311
1-(4-hydroxypentylsulfamoyl)piperidine-2-carboxylic acid
CID 106120554
ethyl 1-(2-hydroxypropylsulfamoyl)pyrrolidine-2-carboxylate
CID 43502369
1-[1-(2-methylsulfonylethylsulfonyl)piperidin-2-yl]ethanone
CID 63845863
1-[[(2R)-1-hydroxypropan-2-yl]sulfamoyl]piperidine-2-carboxylic acid
CID 107215422
1-(cyclopentylmethylsulfamoyl)piperidine-2-carboxylic acid
CID 60857626

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The IUPAC name of 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide (CID 114815335) is 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide.
What is the SMILES notation for 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The canonical SMILES for 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide is CC(=O)C1CCCCN1S(=O)(=O)NCC(C)C.
What is the InChIKey of 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The InChIKey is HTOQNJRBOMOXCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-9(2)8-12-17(15,16)13-7-5-4-6-11(13)10(3)14/h9,11-12H,4-8H2,1-3H3.
What are the key properties of 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-(2-methylpropyl)piperidine-1-sulfonamide is sourced from PubChem (CID 114815335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).