3-methyl-1-thiophen-3-ylcyclopentan-1-ol

C10H14OS — CID 65099854

IUPAC3-methyl-1-thiophen-3-ylcyclopentan-1-ol
SMILESCC1CCC(O)(c2ccsc2)C1
InChIInChI=1S/C10H14OS/c1-8-2-4-10(11,6-8)9-3-5-12-7-9/h3,5,7-8,11H,2,4,6H2,1H3
InChIKeyIIAZTTDTTLTPQB-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.76
Rot. Bonds1

About 3-methyl-1-thiophen-3-ylcyclopentan-1-ol

3-methyl-1-thiophen-3-ylcyclopentan-1-ol (PubChem CID 65099854) has the molecular formula C10H14OS and a molecular weight of 182.29 g/mol. Its IUPAC name is 3-methyl-1-thiophen-3-ylcyclopentan-1-ol.

Molecular Properties

Compound Name3-methyl-1-thiophen-3-ylcyclopentan-1-ol
PubChem CID65099854
Molecular FormulaC10H14OS
Molecular Weight182.29 g/mol
Exact Mass182.08
IUPAC Name3-methyl-1-thiophen-3-ylcyclopentan-1-ol
SMILESCC1CCC(O)(c2ccsc2)C1
InChIInChI=1S/C10H14OS/c1-8-2-4-10(11,6-8)9-3-5-12-7-9/h3,5,7-8,11H,2,4,6H2,1H3
InChIKeyIIAZTTDTTLTPQB-UHFFFAOYSA-N
XLogP2.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-thiophen-3-ylcyclopentan-1-ol?
The IUPAC name of 3-methyl-1-thiophen-3-ylcyclopentan-1-ol (CID 65099854) is 3-methyl-1-thiophen-3-ylcyclopentan-1-ol.
What is the SMILES notation for 3-methyl-1-thiophen-3-ylcyclopentan-1-ol?
The canonical SMILES for 3-methyl-1-thiophen-3-ylcyclopentan-1-ol is CC1CCC(O)(c2ccsc2)C1.
What is the InChIKey of 3-methyl-1-thiophen-3-ylcyclopentan-1-ol?
The InChIKey is IIAZTTDTTLTPQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14OS/c1-8-2-4-10(11,6-8)9-3-5-12-7-9/h3,5,7-8,11H,2,4,6H2,1H3.
What are the key properties of 3-methyl-1-thiophen-3-ylcyclopentan-1-ol?
3-methyl-1-thiophen-3-ylcyclopentan-1-ol has a molecular weight of 182.29 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-thiophen-3-ylcyclopentan-1-ol is sourced from PubChem (CID 65099854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).