4-(3-ethylsulfonylpropyl)piperidine

C10H21NO2S — CID 106779373

IUPAC4-(3-ethylsulfonylpropyl)piperidine
SMILESCCS(=O)(=O)CCCC1CCNCC1
InChIInChI=1S/C10H21NO2S/c1-2-14(12,13)9-3-4-10-5-7-11-8-6-10/h10-11H,2-9H2,1H3
InChIKeyVIDZUQMDQARBFR-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.20
Rot. Bonds5

About 4-(3-ethylsulfonylpropyl)piperidine

4-(3-ethylsulfonylpropyl)piperidine (PubChem CID 106779373) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 4-(3-ethylsulfonylpropyl)piperidine.

Molecular Properties

Compound Name4-(3-ethylsulfonylpropyl)piperidine
PubChem CID106779373
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name4-(3-ethylsulfonylpropyl)piperidine
SMILESCCS(=O)(=O)CCCC1CCNCC1
InChIInChI=1S/C10H21NO2S/c1-2-14(12,13)9-3-4-10-5-7-11-8-6-10/h10-11H,2-9H2,1H3
InChIKeyVIDZUQMDQARBFR-UHFFFAOYSA-N
XLogP1.20
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-ethylsulfonylpropyl)piperidine?
The IUPAC name of 4-(3-ethylsulfonylpropyl)piperidine (CID 106779373) is 4-(3-ethylsulfonylpropyl)piperidine.
What is the SMILES notation for 4-(3-ethylsulfonylpropyl)piperidine?
The canonical SMILES for 4-(3-ethylsulfonylpropyl)piperidine is CCS(=O)(=O)CCCC1CCNCC1.
What is the InChIKey of 4-(3-ethylsulfonylpropyl)piperidine?
The InChIKey is VIDZUQMDQARBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-2-14(12,13)9-3-4-10-5-7-11-8-6-10/h10-11H,2-9H2,1H3.
What are the key properties of 4-(3-ethylsulfonylpropyl)piperidine?
4-(3-ethylsulfonylpropyl)piperidine has a molecular weight of 219.35 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethylsulfonylpropyl)piperidine is sourced from PubChem (CID 106779373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).