N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide

C11H22N2O3S — CID 106402434

IUPACN-(2-but-3-enoxyethyl)piperidine-3-sulfonamide
SMILESC=CCCOCCNS(=O)(=O)C1CCCNC1
InChIInChI=1S/C11H22N2O3S/c1-2-3-8-16-9-7-13-17(14,15)11-5-4-6-12-10-11/h2,11-13H,1,3-10H2
InChIKeyWGAKUJPFGIAUKO-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.25
Rot. Bonds8

About N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide

N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide (PubChem CID 106402434) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-but-3-enoxyethyl)piperidine-3-sulfonamide
PubChem CID106402434
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-(2-but-3-enoxyethyl)piperidine-3-sulfonamide
SMILESC=CCCOCCNS(=O)(=O)C1CCCNC1
InChIInChI=1S/C11H22N2O3S/c1-2-3-8-16-9-7-13-17(14,15)11-5-4-6-12-10-11/h2,11-13H,1,3-10H2
InChIKeyWGAKUJPFGIAUKO-UHFFFAOYSA-N
XLogP0.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[2-(dimethylamino)ethyl]piperidine-3-sulfonamide
CID 24699413
N-(3-methylbutyl)piperidine-3-sulfonamide
CID 24702359
N-(4,4,4-trifluorobutyl)piperidine-3-sulfonamide
CID 113327829
N-(2-but-3-enoxyethyl)-2-methyl-2-piperidin-3-ylpropanamide
CID 106398324
N-[2-[ethyl(methyl)amino]ethyl]piperidine-3-sulfonamide
CID 62636011
N-(7-methyloctyl)piperidine-3-sulfonamide
CID 107816777
N-(2-methoxypropyl)piperidine-3-sulfonamide
CID 102699245
N-[2-(5-bromothiophen-2-yl)ethyl]piperidine-3-sulfonamide
CID 106049253
N-[2-[butan-2-yl(methyl)amino]ethyl]piperidine-3-sulfonamide
CID 114134808
N-(2-piperidin-3-ylethyl)but-3-ene-1-sulfonamide
CID 119979538
N-(2-but-3-enoxyethyl)propane-1-sulfonamide
CID 103854037
N-(2-cyclohexylethyl)pyrrolidine-3-sulfonamide
CID 65421145

Frequently Asked Questions

What is the IUPAC name of N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide?
The IUPAC name of N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide (CID 106402434) is N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide.
What is the SMILES notation for N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide?
The canonical SMILES for N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide is C=CCCOCCNS(=O)(=O)C1CCCNC1.
What is the InChIKey of N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide?
The InChIKey is WGAKUJPFGIAUKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-2-3-8-16-9-7-13-17(14,15)11-5-4-6-12-10-11/h2,11-13H,1,3-10H2.
What are the key properties of N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide?
N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.25, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-but-3-enoxyethyl)piperidine-3-sulfonamide is sourced from PubChem (CID 106402434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).