1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol

C10H9ClOS2 — CID 130767599

IUPAC1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1csc(Cl)c1
InChIInChI=1S/C10H9ClOS2/c11-10-4-7(6-14-10)9(12)5-8-2-1-3-13-8/h1-4,6,9,12H,5H2
InChIKeyQOCZDYRIKNQJGH-UHFFFAOYSA-N
MW244.77 g/mol
LogP3.74
Rot. Bonds3

About 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol

1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol (PubChem CID 130767599) has the molecular formula C10H9ClOS2 and a molecular weight of 244.77 g/mol. Its IUPAC name is 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol
PubChem CID130767599
Molecular FormulaC10H9ClOS2
Molecular Weight244.77 g/mol
Exact Mass243.98
IUPAC Name1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1csc(Cl)c1
InChIInChI=1S/C10H9ClOS2/c11-10-4-7(6-14-10)9(12)5-8-2-1-3-13-8/h1-4,6,9,12H,5H2
InChIKeyQOCZDYRIKNQJGH-UHFFFAOYSA-N
XLogP3.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.77
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol
CID 62608803
1-(3-aminophenyl)-2-thiophen-2-ylethanol
CID 106695892
1-(2,6-dimethyl-4-pyridinyl)-2-thiophen-2-ylethanol
CID 107502914
1-(4-phenylphenyl)-2-thiophen-2-ylethanol
CID 65148567
1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-thiophen-2-ylethanol
CID 65150505
2-thiophen-2-yl-1-(2,4,6-trifluorophenyl)ethanol
CID 65100301
1-(6-methyl-3-pyridinyl)-2-thiophen-2-ylethanol
CID 63155413
4-(1-hydroxy-2-thiophen-2-ylethyl)benzonitrile
CID 115481022
1-(4-methoxyphenyl)-2-thiophen-2-ylethanol
CID 62501005
1-(3,4-dimethoxyphenyl)-2-thiophen-2-ylethanol
CID 55136258
1-(4-fluoro-3-methylphenyl)-2-thiophen-2-ylethanol
CID 62607449
1-chloro-3-thiophen-2-ylpropan-2-ol
CID 82254078

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol?
The IUPAC name of 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol (CID 130767599) is 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol.
What is the SMILES notation for 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol?
The canonical SMILES for 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol is OC(Cc1cccs1)c1csc(Cl)c1.
What is the InChIKey of 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol?
The InChIKey is QOCZDYRIKNQJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClOS2/c11-10-4-7(6-14-10)9(12)5-8-2-1-3-13-8/h1-4,6,9,12H,5H2.
What are the key properties of 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol?
1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol has a molecular weight of 244.77 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol is sourced from PubChem (CID 130767599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).