N-(1-ethylpiperidin-4-yl)ethanesulfonamide

C9H20N2O2S — CID 22772590

IUPACN-(1-ethylpiperidin-4-yl)ethanesulfonamide
SMILESCCN1CCC(NS(=O)(=O)CC)CC1
InChIInChI=1S/C9H20N2O2S/c1-3-11-7-5-9(6-8-11)10-14(12,13)4-2/h9-10H,3-8H2,1-2H3
InChIKeyNPYMKPLFHVTEOO-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.41
Rot. Bonds4

About N-(1-ethylpiperidin-4-yl)ethanesulfonamide

N-(1-ethylpiperidin-4-yl)ethanesulfonamide (PubChem CID 22772590) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)ethanesulfonamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)ethanesulfonamide
PubChem CID22772590
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(1-ethylpiperidin-4-yl)ethanesulfonamide
SMILESCCN1CCC(NS(=O)(=O)CC)CC1
InChIInChI=1S/C9H20N2O2S/c1-3-11-7-5-9(6-8-11)10-14(12,13)4-2/h9-10H,3-8H2,1-2H3
InChIKeyNPYMKPLFHVTEOO-UHFFFAOYSA-N
XLogP0.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)ethanesulfonamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)ethanesulfonamide (CID 22772590) is N-(1-ethylpiperidin-4-yl)ethanesulfonamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)ethanesulfonamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)ethanesulfonamide is CCN1CCC(NS(=O)(=O)CC)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)ethanesulfonamide?
The InChIKey is NPYMKPLFHVTEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-3-11-7-5-9(6-8-11)10-14(12,13)4-2/h9-10H,3-8H2,1-2H3.
What are the key properties of N-(1-ethylpiperidin-4-yl)ethanesulfonamide?
N-(1-ethylpiperidin-4-yl)ethanesulfonamide has a molecular weight of 220.34 g/mol, XLogP of 0.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)ethanesulfonamide is sourced from PubChem (CID 22772590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).