N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide

C10H19N3O2S — CID 61124704

IUPACN-(2-cyanobutan-2-yl)piperidine-1-sulfonamide
SMILESCCC(C)(C#N)NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C10H19N3O2S/c1-3-10(2,9-11)12-16(14,15)13-7-5-4-6-8-13/h12H,3-8H2,1-2H3
InChIKeyHUPPEJGOOWFTKZ-UHFFFAOYSA-N
MW245.35 g/mol
LogP1.00
Rot. Bonds4

About N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide

N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide (PubChem CID 61124704) has the molecular formula C10H19N3O2S and a molecular weight of 245.35 g/mol. Its IUPAC name is N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-cyanobutan-2-yl)piperidine-1-sulfonamide
PubChem CID61124704
Molecular FormulaC10H19N3O2S
Molecular Weight245.35 g/mol
Exact Mass245.12
IUPAC NameN-(2-cyanobutan-2-yl)piperidine-1-sulfonamide
SMILESCCC(C)(C#N)NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C10H19N3O2S/c1-3-10(2,9-11)12-16(14,15)13-7-5-4-6-8-13/h12H,3-8H2,1-2H3
InChIKeyHUPPEJGOOWFTKZ-UHFFFAOYSA-N
XLogP1.00
TPSA73.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.35
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-ethylbutyl)piperidine-1-sulfonamide
CID 91645913
N-tert-butylpiperidine-1-sulfonamide
CID 14493220
N-(2-methylbutan-2-yl)piperidine-1-sulfonamide
CID 126657702
N-(2-methylpentan-2-yl)piperidine-1-sulfonamide
CID 130342800
4-amino-N,N,4-trimethylpiperidine-1-sulfonamide;hydrochloride
CID 130683843
N-(2-methylhexan-2-yl)piperidine-1-sulfonamide
CID 138623370
1-Tert-butyl-4-[[2-cyanoethyl(methyl)sulfamoyl]amino]piperidine
CID 47305798
4-Cyano-1-methyl-4-[[methyl(propan-2-yl)sulfamoyl]amino]piperidine
CID 54947100
N-(1-cyanopropyl)piperidine-1-sulfonamide
CID 55137933
N-(2-cyanopropan-2-yl)piperidine-1-sulfonamide
CID 55138927
4-Cyano-4-(dimethylsulfamoylamino)-1-methylpiperidine
CID 55139325
N-(1-cyanopropan-2-yl)-2-methylpiperidine-1-sulfonamide
CID 55209316

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide?
The IUPAC name of N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide (CID 61124704) is N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide?
The canonical SMILES for N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide is CCC(C)(C#N)NS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide?
The InChIKey is HUPPEJGOOWFTKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2S/c1-3-10(2,9-11)12-16(14,15)13-7-5-4-6-8-13/h12H,3-8H2,1-2H3.
What are the key properties of N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide?
N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide has a molecular weight of 245.35 g/mol, XLogP of 1.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanobutan-2-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 61124704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).