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

C8H7ClN2O2S — CID 130815155

IUPAC1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol
SMILESOC(Cc1cnsn1)c1ccc(Cl)o1
InChIInChI=1S/C8H7ClN2O2S/c9-8-2-1-7(13-8)6(12)3-5-4-10-14-11-5/h1-2,4,6,12H,3H2
InChIKeyATEYNPWGKBBLIN-UHFFFAOYSA-N
MW230.68 g/mol
LogP2.06
Rot. Bonds3

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

1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol (PubChem CID 130815155) has the molecular formula C8H7ClN2O2S and a molecular weight of 230.68 g/mol. Its IUPAC name is 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol.

Molecular Properties

Compound Name1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol
PubChem CID130815155
Molecular FormulaC8H7ClN2O2S
Molecular Weight230.68 g/mol
Exact Mass229.99
IUPAC Name1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol
SMILESOC(Cc1cnsn1)c1ccc(Cl)o1
InChIInChI=1S/C8H7ClN2O2S/c9-8-2-1-7(13-8)6(12)3-5-4-10-14-11-5/h1-2,4,6,12H,3H2
InChIKeyATEYNPWGKBBLIN-UHFFFAOYSA-N
XLogP2.06
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.68
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-phenyl-2-(1,2,5-thiadiazol-3-yl)ethanol
CID 131219601
1-(5-chlorofuran-2-yl)-2-(3,5-dimethylphenyl)ethanol
CID 106693567
1-(5-chlorofuran-2-yl)-2-(5-ethylthiophen-2-yl)ethanol
CID 106693642
(1R)-2-amino-1-(5-chlorofuran-2-yl)ethanol
CID 96633937
2-hydroxy-3-(1,2,5-thiadiazol-3-yl)propanal
CID 130815190
2-(2-bromophenyl)-1-(5-chlorofuran-2-yl)ethanol
CID 106693547
1-(5-chlorofuran-2-yl)-3-methylpentan-1-ol
CID 106693662
2-(1,2,5-thiadiazol-3-ylmethyl)butan-1-ol
CID 131227000
1-(5-chlorofuran-2-yl)-2-pyridin-3-yloxyethanol
CID 117240237
1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 106693891
2-(3-chloro-2-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 102867495
1-(1,3-dioxolan-2-yl)-3-(1,2,5-thiadiazol-3-yl)propan-2-amine
CID 131227529

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol?
The IUPAC name of 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol (CID 130815155) is 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol.
What is the SMILES notation for 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol?
The canonical SMILES for 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol is OC(Cc1cnsn1)c1ccc(Cl)o1.
What is the InChIKey of 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol?
The InChIKey is ATEYNPWGKBBLIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2O2S/c9-8-2-1-7(13-8)6(12)3-5-4-10-14-11-5/h1-2,4,6,12H,3H2.
What are the key properties of 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol?
1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol has a molecular weight of 230.68 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorofuran-2-yl)-2-(1,2,5-thiadiazol-3-yl)ethanol is sourced from PubChem (CID 130815155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).