3-methyl-1-thiophen-2-ylcyclopentan-1-ol

C10H14OS — CID 64513369

IUPAC3-methyl-1-thiophen-2-ylcyclopentan-1-ol
SMILESCC1CCC(O)(c2cccs2)C1
InChIInChI=1S/C10H14OS/c1-8-4-5-10(11,7-8)9-3-2-6-12-9/h2-3,6,8,11H,4-5,7H2,1H3
InChIKeyQBAIGVPAPYAPHT-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.76
Rot. Bonds1

About 3-methyl-1-thiophen-2-ylcyclopentan-1-ol

3-methyl-1-thiophen-2-ylcyclopentan-1-ol (PubChem CID 64513369) has the molecular formula C10H14OS and a molecular weight of 182.29 g/mol. Its IUPAC name is 3-methyl-1-thiophen-2-ylcyclopentan-1-ol.

Molecular Properties

Compound Name3-methyl-1-thiophen-2-ylcyclopentan-1-ol
PubChem CID64513369
Molecular FormulaC10H14OS
Molecular Weight182.29 g/mol
Exact Mass182.08
IUPAC Name3-methyl-1-thiophen-2-ylcyclopentan-1-ol
SMILESCC1CCC(O)(c2cccs2)C1
InChIInChI=1S/C10H14OS/c1-8-4-5-10(11,7-8)9-3-2-6-12-9/h2-3,6,8,11H,4-5,7H2,1H3
InChIKeyQBAIGVPAPYAPHT-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-2-ylcyclopentan-1-ol?
The IUPAC name of 3-methyl-1-thiophen-2-ylcyclopentan-1-ol (CID 64513369) is 3-methyl-1-thiophen-2-ylcyclopentan-1-ol.
What is the SMILES notation for 3-methyl-1-thiophen-2-ylcyclopentan-1-ol?
The canonical SMILES for 3-methyl-1-thiophen-2-ylcyclopentan-1-ol is CC1CCC(O)(c2cccs2)C1.
What is the InChIKey of 3-methyl-1-thiophen-2-ylcyclopentan-1-ol?
The InChIKey is QBAIGVPAPYAPHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14OS/c1-8-4-5-10(11,7-8)9-3-2-6-12-9/h2-3,6,8,11H,4-5,7H2,1H3.
What are the key properties of 3-methyl-1-thiophen-2-ylcyclopentan-1-ol?
3-methyl-1-thiophen-2-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-2-ylcyclopentan-1-ol is sourced from PubChem (CID 64513369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).