2-methylpropane;piperidine-3-sulfonamide

C9H22N2O2S — CID 162108453

IUPAC2-methylpropane;piperidine-3-sulfonamide
SMILESCC(C)C.NS(=O)(=O)C1CCCNC1
InChIInChI=1S/C5H12N2O2S.C4H10/c6-10(8,9)5-2-1-3-7-4-5;1-4(2)3/h5,7H,1-4H2,(H2,6,8,9);4H,1-3H3
InChIKeyZFUYXPJKDBWTJI-UHFFFAOYSA-N
MW222.35 g/mol
LogP0.69
Rot. Bonds1

About 2-methylpropane;piperidine-3-sulfonamide

2-methylpropane;piperidine-3-sulfonamide (PubChem CID 162108453) has the molecular formula C9H22N2O2S and a molecular weight of 222.35 g/mol. Its IUPAC name is 2-methylpropane;piperidine-3-sulfonamide.

Molecular Properties

Compound Name2-methylpropane;piperidine-3-sulfonamide
PubChem CID162108453
Molecular FormulaC9H22N2O2S
Molecular Weight222.35 g/mol
Exact Mass222.14
IUPAC Name2-methylpropane;piperidine-3-sulfonamide
SMILESCC(C)C.NS(=O)(=O)C1CCCNC1
InChIInChI=1S/C5H12N2O2S.C4H10/c6-10(8,9)5-2-1-3-7-4-5;1-4(2)3/h5,7H,1-4H2,(H2,6,8,9);4H,1-3H3
InChIKeyZFUYXPJKDBWTJI-UHFFFAOYSA-N
XLogP0.69
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.35
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

azepane-4-sulfonamide
CID 137380068
(3S)-3-methylsulfonylpiperidine;hydrochloride
CID 122170301
3-propan-2-ylsulfonylazepane
CID 102921107
3-cyclobutylsulfonylpiperidine
CID 115070306
2-piperidin-3-ylsulfonylacetamide
CID 84755061
N-(3-methylbutyl)piperidine-3-sulfonamide
CID 24702359
3-butan-2-ylsulfonylazepane
CID 106512763
N-cyclopropyl-N-(2-methylpropyl)piperidine-3-sulfonamide
CID 55001459
4-propan-2-ylsulfonylazepane
CID 115070337
piperidin-3-yl sulfamate
CID 164534332
N-(2-methoxypropyl)piperidine-3-sulfonamide
CID 102699245
N-[2-[butan-2-yl(methyl)amino]ethyl]piperidine-3-sulfonamide
CID 114134808

Frequently Asked Questions

What is the IUPAC name of 2-methylpropane;piperidine-3-sulfonamide?
The IUPAC name of 2-methylpropane;piperidine-3-sulfonamide (CID 162108453) is 2-methylpropane;piperidine-3-sulfonamide.
What is the SMILES notation for 2-methylpropane;piperidine-3-sulfonamide?
The canonical SMILES for 2-methylpropane;piperidine-3-sulfonamide is CC(C)C.NS(=O)(=O)C1CCCNC1.
What is the InChIKey of 2-methylpropane;piperidine-3-sulfonamide?
The InChIKey is ZFUYXPJKDBWTJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2S.C4H10/c6-10(8,9)5-2-1-3-7-4-5;1-4(2)3/h5,7H,1-4H2,(H2,6,8,9);4H,1-3H3.
What are the key properties of 2-methylpropane;piperidine-3-sulfonamide?
2-methylpropane;piperidine-3-sulfonamide has a molecular weight of 222.35 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropane;piperidine-3-sulfonamide is sourced from PubChem (CID 162108453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).