4-(4-fluorophenyl)-5-methylthiadiazole

C9H7FN2S — CID 69206034

IUPAC4-(4-fluorophenyl)-5-methylthiadiazole
SMILESCc1snnc1-c1ccc(F)cc1
InChIInChI=1S/C9H7FN2S/c1-6-9(11-12-13-6)7-2-4-8(10)5-3-7/h2-5H,1H3
InChIKeyGNABGIJQAUPZLO-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.65
Rot. Bonds1

About 4-(4-fluorophenyl)-5-methylthiadiazole

4-(4-fluorophenyl)-5-methylthiadiazole (PubChem CID 69206034) has the molecular formula C9H7FN2S and a molecular weight of 194.23 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-methylthiadiazole.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-methylthiadiazole
PubChem CID69206034
Molecular FormulaC9H7FN2S
Molecular Weight194.23 g/mol
Exact Mass194.03
IUPAC Name4-(4-fluorophenyl)-5-methylthiadiazole
SMILESCc1snnc1-c1ccc(F)cc1
InChIInChI=1S/C9H7FN2S/c1-6-9(11-12-13-6)7-2-4-8(10)5-3-7/h2-5H,1H3
InChIKeyGNABGIJQAUPZLO-UHFFFAOYSA-N
XLogP2.65
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-methylthiadiazole?
The IUPAC name of 4-(4-fluorophenyl)-5-methylthiadiazole (CID 69206034) is 4-(4-fluorophenyl)-5-methylthiadiazole.
What is the SMILES notation for 4-(4-fluorophenyl)-5-methylthiadiazole?
The canonical SMILES for 4-(4-fluorophenyl)-5-methylthiadiazole is Cc1snnc1-c1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-5-methylthiadiazole?
The InChIKey is GNABGIJQAUPZLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FN2S/c1-6-9(11-12-13-6)7-2-4-8(10)5-3-7/h2-5H,1H3.
What are the key properties of 4-(4-fluorophenyl)-5-methylthiadiazole?
4-(4-fluorophenyl)-5-methylthiadiazole has a molecular weight of 194.23 g/mol, XLogP of 2.65, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-methylthiadiazole is sourced from PubChem (CID 69206034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).