1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol

C14H12OS2 — CID 63016384

IUPAC1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1cc2ccccc2s1
InChIInChI=1S/C14H12OS2/c15-12(9-11-5-3-7-16-11)14-8-10-4-1-2-6-13(10)17-14/h1-8,12,15H,9H2
InChIKeyBFALRNXDZCKMNU-UHFFFAOYSA-N
MW260.38 g/mol
LogP4.24
Rot. Bonds3

About 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol

1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol (PubChem CID 63016384) has the molecular formula C14H12OS2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol
PubChem CID63016384
Molecular FormulaC14H12OS2
Molecular Weight260.38 g/mol
Exact Mass260.03
IUPAC Name1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1cc2ccccc2s1
InChIInChI=1S/C14H12OS2/c15-12(9-11-5-3-7-16-11)14-8-10-4-1-2-6-13(10)17-14/h1-8,12,15H,9H2
InChIKeyBFALRNXDZCKMNU-UHFFFAOYSA-N
XLogP4.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-benzothiophen-2-yl)-2-(4-ethylphenyl)ethanol
CID 114980831
(1R)-1-(1-benzothiophen-2-yl)propan-1-ol
CID 171099380
1-(1-benzothiophen-2-yl)-3-methylbutan-1-ol
CID 114976256
1-(1-benzothiophen-2-yl)-2-[4-(pentafluoro-λ6-sulfanyl)phenyl]ethanol
CID 177491448
(3R)-3-(1-benzothiophen-2-yl)-3-hydroxypropanoic acid
CID 102424617
1-(1-benzothiophen-2-yl)-2-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 115803448
2-[bromo(thiophen-2-yl)methyl]-1-benzothiophene
CID 63442235
1-(2-fluorophenyl)-2-thiophen-2-ylethanol
CID 62501519
1-(1-benzothiophen-2-yl)nonan-1-ol
CID 115784008
1-(1-benzothiophen-2-yl)-3-(dimethylamino)propan-1-ol
CID 86678604
1-(1-benzothiophen-2-yl)-2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanol
CID 115814230
1-(1-benzothiophen-2-yl)-2-(1-ethylimidazol-2-yl)ethanol
CID 115819253

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol?
The IUPAC name of 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol (CID 63016384) is 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol.
What is the SMILES notation for 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol?
The canonical SMILES for 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol is OC(Cc1cccs1)c1cc2ccccc2s1.
What is the InChIKey of 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol?
The InChIKey is BFALRNXDZCKMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12OS2/c15-12(9-11-5-3-7-16-11)14-8-10-4-1-2-6-13(10)17-14/h1-8,12,15H,9H2.
What are the key properties of 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol?
1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol has a molecular weight of 260.38 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzothiophen-2-yl)-2-thiophen-2-ylethanol is sourced from PubChem (CID 63016384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).