3-ethyl-1-thiophen-3-ylcyclopentan-1-ol

C11H16OS — CID 65099913

IUPAC3-ethyl-1-thiophen-3-ylcyclopentan-1-ol
SMILESCCC1CCC(O)(c2ccsc2)C1
InChIInChI=1S/C11H16OS/c1-2-9-3-5-11(12,7-9)10-4-6-13-8-10/h4,6,8-9,12H,2-3,5,7H2,1H3
InChIKeyDCSAOSQEXMSDSQ-UHFFFAOYSA-N
MW196.32 g/mol
LogP3.15
Rot. Bonds2

About 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol

3-ethyl-1-thiophen-3-ylcyclopentan-1-ol (PubChem CID 65099913) has the molecular formula C11H16OS and a molecular weight of 196.32 g/mol. Its IUPAC name is 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol.

Molecular Properties

Compound Name3-ethyl-1-thiophen-3-ylcyclopentan-1-ol
PubChem CID65099913
Molecular FormulaC11H16OS
Molecular Weight196.32 g/mol
Exact Mass196.09
IUPAC Name3-ethyl-1-thiophen-3-ylcyclopentan-1-ol
SMILESCCC1CCC(O)(c2ccsc2)C1
InChIInChI=1S/C11H16OS/c1-2-9-3-5-11(12,7-9)10-4-6-13-8-10/h4,6,8-9,12H,2-3,5,7H2,1H3
InChIKeyDCSAOSQEXMSDSQ-UHFFFAOYSA-N
XLogP3.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol?
The IUPAC name of 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol (CID 65099913) is 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol.
What is the SMILES notation for 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol?
The canonical SMILES for 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol is CCC1CCC(O)(c2ccsc2)C1.
What is the InChIKey of 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol?
The InChIKey is DCSAOSQEXMSDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OS/c1-2-9-3-5-11(12,7-9)10-4-6-13-8-10/h4,6,8-9,12H,2-3,5,7H2,1H3.
What are the key properties of 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol?
3-ethyl-1-thiophen-3-ylcyclopentan-1-ol has a molecular weight of 196.32 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-thiophen-3-ylcyclopentan-1-ol is sourced from PubChem (CID 65099913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).