1-cyclopentyl-2-thiophen-2-ylsulfonylethanone

C11H14O3S2 — CID 104756093

IUPAC1-cyclopentyl-2-thiophen-2-ylsulfonylethanone
SMILESO=C(CS(=O)(=O)c1cccs1)C1CCCC1
InChIInChI=1S/C11H14O3S2/c12-10(9-4-1-2-5-9)8-16(13,14)11-6-3-7-15-11/h3,6-7,9H,1-2,4-5,8H2
InChIKeyONIHYQUIOWPFLW-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.28
Rot. Bonds4

About 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone

1-cyclopentyl-2-thiophen-2-ylsulfonylethanone (PubChem CID 104756093) has the molecular formula C11H14O3S2 and a molecular weight of 258.36 g/mol. Its IUPAC name is 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone.

Molecular Properties

Compound Name1-cyclopentyl-2-thiophen-2-ylsulfonylethanone
PubChem CID104756093
Molecular FormulaC11H14O3S2
Molecular Weight258.36 g/mol
Exact Mass258.04
IUPAC Name1-cyclopentyl-2-thiophen-2-ylsulfonylethanone
SMILESO=C(CS(=O)(=O)c1cccs1)C1CCCC1
InChIInChI=1S/C11H14O3S2/c12-10(9-4-1-2-5-9)8-16(13,14)11-6-3-7-15-11/h3,6-7,9H,1-2,4-5,8H2
InChIKeyONIHYQUIOWPFLW-UHFFFAOYSA-N
XLogP2.28
TPSA51.21 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclohexyl-2-thiophen-2-ylethanone
CID 61056881
1-cyclopentyl-2-(2-methoxyphenyl)sulfonylethanone
CID 104756180
N-cyclopropyl-N-(1-cyclopropylethyl)-2-thiophen-2-ylsulfonylacetamide
CID 71979152
1-(1,3-dihydroisoindol-2-yl)-2-thiophen-2-ylsulfonylethanone
CID 166512178
(2S)-1-thiophen-2-ylsulfonylpiperidine-2-carbonyl chloride
CID 42281719
N-thiophen-2-ylsulfonylcyclopropanecarboxamide
CID 47232134
1-cyclobutyl-3-thiophen-2-ylpropan-1-one
CID 64982146
(3R)-1-thiophen-2-ylsulfonylpiperidine-3-carbonyl chloride
CID 42261450
N-(3-aminophenyl)-2-thiophen-2-ylsulfonylacetamide
CID 43444010
cyclobutyl-[4-(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)piperazin-1-yl]methanone
CID 56510993
N-(4-aminophenyl)-2-thiophen-2-ylsulfonylacetamide
CID 43443995
N-hydroxy-N'-methyl-2-thiophen-2-ylsulfonylethanimidamide
CID 89290734

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone?
The IUPAC name of 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone (CID 104756093) is 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone.
What is the SMILES notation for 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone?
The canonical SMILES for 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone is O=C(CS(=O)(=O)c1cccs1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone?
The InChIKey is ONIHYQUIOWPFLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3S2/c12-10(9-4-1-2-5-9)8-16(13,14)11-6-3-7-15-11/h3,6-7,9H,1-2,4-5,8H2.
What are the key properties of 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone?
1-cyclopentyl-2-thiophen-2-ylsulfonylethanone has a molecular weight of 258.36 g/mol, XLogP of 2.28, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-thiophen-2-ylsulfonylethanone is sourced from PubChem (CID 104756093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).