3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol

C11H22O3S — CID 106732427

IUPAC3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol
SMILESCC(C)(C)S(=O)(=O)CCC1CCC(O)C1
InChIInChI=1S/C11H22O3S/c1-11(2,3)15(13,14)7-6-9-4-5-10(12)8-9/h9-10,12H,4-8H2,1-3H3
InChIKeyXUULVUAQRBLBDK-UHFFFAOYSA-N
MW234.36 g/mol
LogP1.75
Rot. Bonds3

About 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol

3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol (PubChem CID 106732427) has the molecular formula C11H22O3S and a molecular weight of 234.36 g/mol. Its IUPAC name is 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol
PubChem CID106732427
Molecular FormulaC11H22O3S
Molecular Weight234.36 g/mol
Exact Mass234.13
IUPAC Name3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol
SMILESCC(C)(C)S(=O)(=O)CCC1CCC(O)C1
InChIInChI=1S/C11H22O3S/c1-11(2,3)15(13,14)7-6-9-4-5-10(12)8-9/h9-10,12H,4-8H2,1-3H3
InChIKeyXUULVUAQRBLBDK-UHFFFAOYSA-N
XLogP1.75
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.36
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-methylsulfonylethyl)cyclopentan-1-ol
CID 64513199
1-(2-tert-butylsulfonylethyl)-3-chlorocycloheptane
CID 106732503
2-(2-tert-butylsulfonylethyl)oxolane
CID 59159510
3-[[tert-butyl(dimethyl)-λ4-sulfanyl]oxymethyl]cyclopentan-1-ol
CID 142246151
3-[2-(dimethylamino)ethyl]cyclopentan-1-ol
CID 130149238
N-[2-[(3R)-3-hydroxycyclopentyl]ethyl]acetamide
CID 163743916
3-tridecylcyclopentan-1-ol
CID 67606099
2-(2-tert-butylsulfonylethyl)pyrrolidine
CID 84685127
1-(2-tert-butylsulfonylethyl)pyrrolidine-3,4-diol
CID 106729248
N-[(3-hydroxycyclopentyl)methyl]cyclopentanesulfonamide
CID 103270191
trans-(1R,3R)-3-(hydroxymethyl)cyclopentan-1-ol
CID 45098984
N-[(3-hydroxycyclopentyl)methyl]-3,3-dimethylbutanamide
CID 103279887

Frequently Asked Questions

What is the IUPAC name of 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol?
The IUPAC name of 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol (CID 106732427) is 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol.
What is the SMILES notation for 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol?
The canonical SMILES for 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol is CC(C)(C)S(=O)(=O)CCC1CCC(O)C1.
What is the InChIKey of 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol?
The InChIKey is XUULVUAQRBLBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3S/c1-11(2,3)15(13,14)7-6-9-4-5-10(12)8-9/h9-10,12H,4-8H2,1-3H3.
What are the key properties of 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol?
3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol has a molecular weight of 234.36 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-tert-butylsulfonylethyl)cyclopentan-1-ol is sourced from PubChem (CID 106732427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).