1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol

C15H18OS2 — CID 58568196

IUPAC1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol
SMILESCC(O)(c1ccsc1-c1cccs1)C1CCCC1
InChIInChI=1S/C15H18OS2/c1-15(16,11-5-2-3-6-11)12-8-10-18-14(12)13-7-4-9-17-13/h4,7-11,16H,2-3,5-6H2,1H3
InChIKeyAHJHRYQUCPCCNH-UHFFFAOYSA-N
MW278.44 g/mol
LogP4.87
Rot. Bonds3

About 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol

1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol (PubChem CID 58568196) has the molecular formula C15H18OS2 and a molecular weight of 278.44 g/mol. Its IUPAC name is 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol.

Molecular Properties

Compound Name1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol
PubChem CID58568196
Molecular FormulaC15H18OS2
Molecular Weight278.44 g/mol
Exact Mass278.08
IUPAC Name1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol
SMILESCC(O)(c1ccsc1-c1cccs1)C1CCCC1
InChIInChI=1S/C15H18OS2/c1-15(16,11-5-2-3-6-11)12-8-10-18-14(12)13-7-4-9-17-13/h4,7-11,16H,2-3,5-6H2,1H3
InChIKeyAHJHRYQUCPCCNH-UHFFFAOYSA-N
XLogP4.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol?
The IUPAC name of 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol (CID 58568196) is 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol.
What is the SMILES notation for 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol?
The canonical SMILES for 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol is CC(O)(c1ccsc1-c1cccs1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol?
The InChIKey is AHJHRYQUCPCCNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18OS2/c1-15(16,11-5-2-3-6-11)12-8-10-18-14(12)13-7-4-9-17-13/h4,7-11,16H,2-3,5-6H2,1H3.
What are the key properties of 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol?
1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol has a molecular weight of 278.44 g/mol, XLogP of 4.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-1-(2-thiophen-2-ylthiophen-3-yl)ethanol is sourced from PubChem (CID 58568196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).