N-piperidin-4-ylethanesulfonamide;hydrochloride

C7H17ClN2O2S — CID 43810658

IUPACN-piperidin-4-ylethanesulfonamide;hydrochloride
SMILESCCS(=O)(=O)NC1CCNCC1.Cl
InChIInChI=1S/C7H16N2O2S.ClH/c1-2-12(10,11)9-7-3-5-8-6-4-7;/h7-9H,2-6H2,1H3;1H
InChIKeyDEKJGUAIMAEZEX-UHFFFAOYSA-N
MW228.74 g/mol
LogP0.10
Rot. Bonds3

About N-piperidin-4-ylethanesulfonamide;hydrochloride

N-piperidin-4-ylethanesulfonamide;hydrochloride (PubChem CID 43810658) has the molecular formula C7H17ClN2O2S and a molecular weight of 228.74 g/mol. Its IUPAC name is N-piperidin-4-ylethanesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-4-ylethanesulfonamide;hydrochloride
PubChem CID43810658
Molecular FormulaC7H17ClN2O2S
Molecular Weight228.74 g/mol
Exact Mass228.07
IUPAC NameN-piperidin-4-ylethanesulfonamide;hydrochloride
SMILESCCS(=O)(=O)NC1CCNCC1.Cl
InChIInChI=1S/C7H16N2O2S.ClH/c1-2-12(10,11)9-7-3-5-8-6-4-7;/h7-9H,2-6H2,1H3;1H
InChIKeyDEKJGUAIMAEZEX-UHFFFAOYSA-N
XLogP0.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.74
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-ylethanesulfonamide;hydrochloride?
The IUPAC name of N-piperidin-4-ylethanesulfonamide;hydrochloride (CID 43810658) is N-piperidin-4-ylethanesulfonamide;hydrochloride.
What is the SMILES notation for N-piperidin-4-ylethanesulfonamide;hydrochloride?
The canonical SMILES for N-piperidin-4-ylethanesulfonamide;hydrochloride is CCS(=O)(=O)NC1CCNCC1.Cl.
What is the InChIKey of N-piperidin-4-ylethanesulfonamide;hydrochloride?
The InChIKey is DEKJGUAIMAEZEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S.ClH/c1-2-12(10,11)9-7-3-5-8-6-4-7;/h7-9H,2-6H2,1H3;1H.
What are the key properties of N-piperidin-4-ylethanesulfonamide;hydrochloride?
N-piperidin-4-ylethanesulfonamide;hydrochloride has a molecular weight of 228.74 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-ylethanesulfonamide;hydrochloride is sourced from PubChem (CID 43810658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).