2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol

C10H12N2OS2 — CID 105087594

IUPAC2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol
SMILESCCc1ccc(CC(O)c2cnsn2)s1
InChIInChI=1S/C10H12N2OS2/c1-2-7-3-4-8(14-7)5-10(13)9-6-11-15-12-9/h3-4,6,10,13H,2,5H2,1H3
InChIKeyQNEGDGIEOLMICD-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.44
Rot. Bonds4

About 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol

2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol (PubChem CID 105087594) has the molecular formula C10H12N2OS2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol
PubChem CID105087594
Molecular FormulaC10H12N2OS2
Molecular Weight240.35 g/mol
Exact Mass240.04
IUPAC Name2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol
SMILESCCc1ccc(CC(O)c2cnsn2)s1
InChIInChI=1S/C10H12N2OS2/c1-2-7-3-4-8(14-7)5-10(13)9-6-11-15-12-9/h3-4,6,10,13H,2,5H2,1H3
InChIKeyQNEGDGIEOLMICD-UHFFFAOYSA-N
XLogP2.44
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-Fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol
CID 130603747
(5-methylthiophen-2-yl)-(2H-triazol-4-yl)methanol
CID 80494698
2-(3-bromothiophen-2-yl)-1-(2H-triazol-4-yl)ethanol
CID 80494726
2-(5-chlorothiophen-2-yl)-1-(2H-triazol-4-yl)ethanol
CID 80494815
2-thiophen-2-yl-1-(2H-triazol-4-yl)ethanol
CID 80494847
2-(5-bromothiophen-2-yl)-1-(2H-triazol-4-yl)ethanol
CID 80494848
2-(5-ethylthiophen-2-yl)-1-(2H-triazol-4-yl)ethanol
CID 80494933
3-thiophen-2-yl-1-(2H-triazol-4-yl)propan-1-ol
CID 80494972
(2-Methylthiophen-3-yl)-(1,2,5-thiadiazol-3-yl)methanol
CID 102842321
1-(1,2,5-Thiadiazol-3-yl)-2-thiophen-2-ylethanol
CID 105087126
2-(5-Bromothiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 105087218
2-(5-Chlorothiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 105087372

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
The IUPAC name of 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol (CID 105087594) is 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol.
What is the SMILES notation for 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
The canonical SMILES for 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol is CCc1ccc(CC(O)c2cnsn2)s1.
What is the InChIKey of 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
The InChIKey is QNEGDGIEOLMICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS2/c1-2-7-3-4-8(14-7)5-10(13)9-6-11-15-12-9/h3-4,6,10,13H,2,5H2,1H3.
What are the key properties of 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol has a molecular weight of 240.35 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylthiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol is sourced from PubChem (CID 105087594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).