4-ethyl-1-thiophen-2-ylsulfonylpiperidine

C11H17NO2S2 — CID 129259597

IUPAC4-ethyl-1-thiophen-2-ylsulfonylpiperidine
SMILESCCC1CCN(S(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C11H17NO2S2/c1-2-10-5-7-12(8-6-10)16(13,14)11-4-3-9-15-11/h3-4,9-10H,2,5-8H2,1H3
InChIKeyCHHKZVYCZCZBTM-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.56
Rot. Bonds3

About 4-ethyl-1-thiophen-2-ylsulfonylpiperidine

4-ethyl-1-thiophen-2-ylsulfonylpiperidine (PubChem CID 129259597) has the molecular formula C11H17NO2S2 and a molecular weight of 259.40 g/mol. Its IUPAC name is 4-ethyl-1-thiophen-2-ylsulfonylpiperidine.

Molecular Properties

Compound Name4-ethyl-1-thiophen-2-ylsulfonylpiperidine
PubChem CID129259597
Molecular FormulaC11H17NO2S2
Molecular Weight259.40 g/mol
Exact Mass259.07
IUPAC Name4-ethyl-1-thiophen-2-ylsulfonylpiperidine
SMILESCCC1CCN(S(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C11H17NO2S2/c1-2-10-5-7-12(8-6-10)16(13,14)11-4-3-9-15-11/h3-4,9-10H,2,5-8H2,1H3
InChIKeyCHHKZVYCZCZBTM-UHFFFAOYSA-N
XLogP2.56
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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1-cyclopropyl-4-thiophen-2-ylsulfonylpiperazine
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1-(2-ethylphenyl)-4-thiophen-2-ylsulfonylpiperazine
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CID 3865892
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piperidin-1-yl-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone
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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-thiophen-2-ylsulfonylpiperidine?
The IUPAC name of 4-ethyl-1-thiophen-2-ylsulfonylpiperidine (CID 129259597) is 4-ethyl-1-thiophen-2-ylsulfonylpiperidine.
What is the SMILES notation for 4-ethyl-1-thiophen-2-ylsulfonylpiperidine?
The canonical SMILES for 4-ethyl-1-thiophen-2-ylsulfonylpiperidine is CCC1CCN(S(=O)(=O)c2cccs2)CC1.
What is the InChIKey of 4-ethyl-1-thiophen-2-ylsulfonylpiperidine?
The InChIKey is CHHKZVYCZCZBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2S2/c1-2-10-5-7-12(8-6-10)16(13,14)11-4-3-9-15-11/h3-4,9-10H,2,5-8H2,1H3.
What are the key properties of 4-ethyl-1-thiophen-2-ylsulfonylpiperidine?
4-ethyl-1-thiophen-2-ylsulfonylpiperidine has a molecular weight of 259.40 g/mol, XLogP of 2.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-thiophen-2-ylsulfonylpiperidine is sourced from PubChem (CID 129259597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).