2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone

C10H10Cl2O2S — CID 62139898

IUPAC2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone
SMILESO=C(COC1CCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C10H10Cl2O2S/c11-9-4-7(10(12)15-9)8(13)5-14-6-2-1-3-6/h4,6H,1-3,5H2
InChIKeyHSBYZEZODGFEDP-UHFFFAOYSA-N
MW265.16 g/mol
LogP3.81
Rot. Bonds4

About 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone

2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone (PubChem CID 62139898) has the molecular formula C10H10Cl2O2S and a molecular weight of 265.16 g/mol. Its IUPAC name is 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone.

Molecular Properties

Compound Name2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone
PubChem CID62139898
Molecular FormulaC10H10Cl2O2S
Molecular Weight265.16 g/mol
Exact Mass263.98
IUPAC Name2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone
SMILESO=C(COC1CCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C10H10Cl2O2S/c11-9-4-7(10(12)15-9)8(13)5-14-6-2-1-3-6/h4,6H,1-3,5H2
InChIKeyHSBYZEZODGFEDP-UHFFFAOYSA-N
XLogP3.81
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.16
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,5-dichlorothiophen-3-yl)-2-(oxetan-3-yloxy)ethanone
CID 102606968
2-cyclobutyl-1-(2,5-dichlorothiophen-3-yl)ethanone
CID 103162435
1-(2,5-dichlorothiophen-3-yl)-2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanone
CID 104967877
1-(2,5-dichlorothiophen-3-yl)-2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanone
CID 43798250
2-(azepan-1-yl)-1-(2,5-dichlorothiophen-3-yl)ethanone
CID 43227260
2-cyclopentylsulfinyl-1-(2,5-dichlorothiophen-3-yl)ethanone
CID 64639379
2-cyclobutyloxy-1-(2,5-difluorophenyl)ethanone
CID 62141584
N-[2-(bromomethyl)cyclopentyl]-2,5-dichlorothiophene-3-carboxamide
CID 106366353
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-1-(2,5-dichlorothiophen-3-yl)ethanone
CID 102727232
2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1-(2,5-dichlorothiophen-3-yl)ethanone
CID 43228932
1-(2,5-dichlorothiophen-3-yl)-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanone
CID 104563843
1-(2,5-dichlorothiophen-3-yl)-2-(thian-4-yl)ethanone
CID 107962795

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone?
The IUPAC name of 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone (CID 62139898) is 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone.
What is the SMILES notation for 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone?
The canonical SMILES for 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone is O=C(COC1CCC1)c1cc(Cl)sc1Cl.
What is the InChIKey of 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone?
The InChIKey is HSBYZEZODGFEDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2O2S/c11-9-4-7(10(12)15-9)8(13)5-14-6-2-1-3-6/h4,6H,1-3,5H2.
What are the key properties of 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone?
2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone has a molecular weight of 265.16 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-1-(2,5-dichlorothiophen-3-yl)ethanone is sourced from PubChem (CID 62139898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).