2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol

C12H14O2S2 — CID 14937463

IUPAC2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol
SMILESOCCc1ccsc1-c1sccc1CCO
InChIInChI=1S/C12H14O2S2/c13-5-1-9-3-7-15-11(9)12-10(2-6-14)4-8-16-12/h3-4,7-8,13-14H,1-2,5-6H2
InChIKeyZPWFWTAEOQZTQT-UHFFFAOYSA-N
MW254.38 g/mol
LogP2.55
Rot. Bonds5

About 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol

2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol (PubChem CID 14937463) has the molecular formula C12H14O2S2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol.

Molecular Properties

Compound Name2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol
PubChem CID14937463
Molecular FormulaC12H14O2S2
Molecular Weight254.38 g/mol
Exact Mass254.04
IUPAC Name2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol
SMILESOCCc1ccsc1-c1sccc1CCO
InChIInChI=1S/C12H14O2S2/c13-5-1-9-3-7-15-11(9)12-10(2-6-14)4-8-16-12/h3-4,7-8,13-14H,1-2,5-6H2
InChIKeyZPWFWTAEOQZTQT-UHFFFAOYSA-N
XLogP2.55
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol?
The IUPAC name of 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol (CID 14937463) is 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol.
What is the SMILES notation for 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol?
The canonical SMILES for 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol is OCCc1ccsc1-c1sccc1CCO.
What is the InChIKey of 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol?
The InChIKey is ZPWFWTAEOQZTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2S2/c13-5-1-9-3-7-15-11(9)12-10(2-6-14)4-8-16-12/h3-4,7-8,13-14H,1-2,5-6H2.
What are the key properties of 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol?
2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol has a molecular weight of 254.38 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(2-hydroxyethyl)thiophen-2-yl]thiophen-3-yl]ethanol is sourced from PubChem (CID 14937463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).