2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole

C7H4FN3S — CID 135397065

IUPAC2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole
SMILESFc1nnc(-c2ccccn2)s1
InChIInChI=1S/C7H4FN3S/c8-7-11-10-6(12-7)5-3-1-2-4-9-5/h1-4H
InChIKeyMHUSIJBBIXOOCH-UHFFFAOYSA-N
MW181.20 g/mol
LogP1.74
Rot. Bonds1

About 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole

2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole (PubChem CID 135397065) has the molecular formula C7H4FN3S and a molecular weight of 181.20 g/mol. Its IUPAC name is 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole.

Molecular Properties

Compound Name2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole
PubChem CID135397065
Molecular FormulaC7H4FN3S
Molecular Weight181.20 g/mol
Exact Mass181.01
IUPAC Name2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole
SMILESFc1nnc(-c2ccccn2)s1
InChIInChI=1S/C7H4FN3S/c8-7-11-10-6(12-7)5-3-1-2-4-9-5/h1-4H
InChIKeyMHUSIJBBIXOOCH-UHFFFAOYSA-N
XLogP1.74
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)methanol
CID 58504238
2-ethyl-5-pyridin-2-yl-1,3,4-thiadiazole
CID 101460116
5-pyridin-2-yl-1,3,4-thiadiazole-2-carboxamide
CID 159760576
N-[1-(4-fluorophenyl)ethyl]-N-methyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
CID 133467718
1-amino-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)cyclopropane-1-carboxamide
CID 119855704
3-[[(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)amino]methyl]pentan-3-ol
CID 133442973
2-(2-methylpentan-3-yl)-5-pyridin-2-yl-1,3,4-thiadiazole
CID 123183756
N-(2-methyl-2-methylsulfonylpropyl)-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
CID 133455175
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole?
The IUPAC name of 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole (CID 135397065) is 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole.
What is the SMILES notation for 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole?
The canonical SMILES for 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole is Fc1nnc(-c2ccccn2)s1.
What is the InChIKey of 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole?
The InChIKey is MHUSIJBBIXOOCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4FN3S/c8-7-11-10-6(12-7)5-3-1-2-4-9-5/h1-4H.
What are the key properties of 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole?
2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole has a molecular weight of 181.20 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-pyridin-2-yl-1,3,4-thiadiazole is sourced from PubChem (CID 135397065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).