2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol

C10H9FN2OS — CID 105079033

IUPAC2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
SMILESOC(Cc1cccc(F)c1)c1csnn1
InChIInChI=1S/C10H9FN2OS/c11-8-3-1-2-7(4-8)5-10(14)9-6-15-13-12-9/h1-4,6,10,14H,5H2
InChIKeyVFRADXXYJORUMR-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.95
Rot. Bonds3

About 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol

2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol (PubChem CID 105079033) has the molecular formula C10H9FN2OS and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
PubChem CID105079033
Molecular FormulaC10H9FN2OS
Molecular Weight224.26 g/mol
Exact Mass224.04
IUPAC Name2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
SMILESOC(Cc1cccc(F)c1)c1csnn1
InChIInChI=1S/C10H9FN2OS/c11-8-3-1-2-7(4-8)5-10(14)9-6-15-13-12-9/h1-4,6,10,14H,5H2
InChIKeyVFRADXXYJORUMR-UHFFFAOYSA-N
XLogP1.95
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(4-Fluorophenyl)-1,2,3-thiadiazol-4-yl]methanol
CID 69206022
Phenyl-(5-phenylthiadiazol-4-yl)methanol
CID 13494837
1-(5-Phenylthiadiazol-4-yl)butan-1-ol
CID 13494838
2-(2-Chloro-5-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 102623171
[2-Methyl-4-(trifluoromethyl)phenyl]-(thiadiazol-4-yl)methanol
CID 102759063
2-(3-Chloro-2-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 102867464
2-(3-Chloro-4-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 103043682
2-(5-Chloro-2-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 103053464
2-(4-Fluorophenyl)-1-(4-methylthiadiazol-5-yl)ethanol
CID 105076984
2-(4-Fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 105077026
1-(4-Ethylthiadiazol-5-yl)-2-(4-fluorophenyl)ethanol
CID 105077031
1-(4-Tert-butylthiadiazol-5-yl)-2-(4-fluorophenyl)ethanol
CID 105077051

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol?
The IUPAC name of 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol (CID 105079033) is 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol.
What is the SMILES notation for 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol?
The canonical SMILES for 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol is OC(Cc1cccc(F)c1)c1csnn1.
What is the InChIKey of 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol?
The InChIKey is VFRADXXYJORUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2OS/c11-8-3-1-2-7(4-8)5-10(14)9-6-15-13-12-9/h1-4,6,10,14H,5H2.
What are the key properties of 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol?
2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol has a molecular weight of 224.26 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-(thiadiazol-4-yl)ethanol is sourced from PubChem (CID 105079033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).