5-ethyl-4-(fluoromethyl)thiadiazole

C5H7FN2S — CID 141237842

IUPAC5-ethyl-4-(fluoromethyl)thiadiazole
SMILESCCc1snnc1CF
InChIInChI=1S/C5H7FN2S/c1-2-5-4(3-6)7-8-9-5/h2-3H2,1H3
InChIKeyDRUOLPJKXQDXKF-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.57
Rot. Bonds2

About 5-ethyl-4-(fluoromethyl)thiadiazole

5-ethyl-4-(fluoromethyl)thiadiazole (PubChem CID 141237842) has the molecular formula C5H7FN2S and a molecular weight of 146.19 g/mol. Its IUPAC name is 5-ethyl-4-(fluoromethyl)thiadiazole.

Molecular Properties

Compound Name5-ethyl-4-(fluoromethyl)thiadiazole
PubChem CID141237842
Molecular FormulaC5H7FN2S
Molecular Weight146.19 g/mol
Exact Mass146.03
IUPAC Name5-ethyl-4-(fluoromethyl)thiadiazole
SMILESCCc1snnc1CF
InChIInChI=1S/C5H7FN2S/c1-2-5-4(3-6)7-8-9-5/h2-3H2,1H3
InChIKeyDRUOLPJKXQDXKF-UHFFFAOYSA-N
XLogP1.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-Bromoethyl)-4-methyl-1,2,3-thiadiazole
CID 12679020
4-Ethyl-5-(fluoromethyl)thiadiazole
CID 141237802
5-Ethyl-4-methylthiadiazole
CID 12679017
4-Methyl-5-propylthiadiazole
CID 12913685
5-(1-Bromoethyl)-4-(difluoromethyl)-1,2,3-thiadiazole
CID 165791852
4-Ethyl-5-methylthiadiazole
CID 12679016
(E)-1-(4-methylthiadiazol-5-yl)ethylidenehydrazine
CID 20717870
(E)-N-methoxy-1-(4-methylthiadiazol-5-yl)ethanimine
CID 20717885
5-Butyl-4-methylthiadiazole
CID 23383489
5-Tert-butyl-4-methylthiadiazole
CID 23529416
4-Methyl-5-propan-2-ylthiadiazole
CID 23588983
4,5-Di(propan-2-yl)thiadiazole
CID 59752180

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-(fluoromethyl)thiadiazole?
The IUPAC name of 5-ethyl-4-(fluoromethyl)thiadiazole (CID 141237842) is 5-ethyl-4-(fluoromethyl)thiadiazole.
What is the SMILES notation for 5-ethyl-4-(fluoromethyl)thiadiazole?
The canonical SMILES for 5-ethyl-4-(fluoromethyl)thiadiazole is CCc1snnc1CF.
What is the InChIKey of 5-ethyl-4-(fluoromethyl)thiadiazole?
The InChIKey is DRUOLPJKXQDXKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN2S/c1-2-5-4(3-6)7-8-9-5/h2-3H2,1H3.
What are the key properties of 5-ethyl-4-(fluoromethyl)thiadiazole?
5-ethyl-4-(fluoromethyl)thiadiazole has a molecular weight of 146.19 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-(fluoromethyl)thiadiazole is sourced from PubChem (CID 141237842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).