4-cyclopropyl-5-(fluoromethyl)thiadiazole

C6H7FN2S — CID 141237817

IUPAC4-cyclopropyl-5-(fluoromethyl)thiadiazole
SMILESFCc1snnc1C1CC1
InChIInChI=1S/C6H7FN2S/c7-3-5-6(4-1-2-4)8-9-10-5/h4H,1-3H2
InChIKeyRAOAXLOHAAUESU-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.88
Rot. Bonds2

About 4-cyclopropyl-5-(fluoromethyl)thiadiazole

4-cyclopropyl-5-(fluoromethyl)thiadiazole (PubChem CID 141237817) has the molecular formula C6H7FN2S and a molecular weight of 158.20 g/mol. Its IUPAC name is 4-cyclopropyl-5-(fluoromethyl)thiadiazole.

Molecular Properties

Compound Name4-cyclopropyl-5-(fluoromethyl)thiadiazole
PubChem CID141237817
Molecular FormulaC6H7FN2S
Molecular Weight158.20 g/mol
Exact Mass158.03
IUPAC Name4-cyclopropyl-5-(fluoromethyl)thiadiazole
SMILESFCc1snnc1C1CC1
InChIInChI=1S/C6H7FN2S/c7-3-5-6(4-1-2-4)8-9-10-5/h4H,1-3H2
InChIKeyRAOAXLOHAAUESU-UHFFFAOYSA-N
XLogP1.88
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-cyclopropyl-5-(fluoromethyl)thiadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-5-(fluoromethyl)thiadiazole?
The IUPAC name of 4-cyclopropyl-5-(fluoromethyl)thiadiazole (CID 141237817) is 4-cyclopropyl-5-(fluoromethyl)thiadiazole.
What is the SMILES notation for 4-cyclopropyl-5-(fluoromethyl)thiadiazole?
The canonical SMILES for 4-cyclopropyl-5-(fluoromethyl)thiadiazole is FCc1snnc1C1CC1.
What is the InChIKey of 4-cyclopropyl-5-(fluoromethyl)thiadiazole?
The InChIKey is RAOAXLOHAAUESU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2S/c7-3-5-6(4-1-2-4)8-9-10-5/h4H,1-3H2.
What are the key properties of 4-cyclopropyl-5-(fluoromethyl)thiadiazole?
4-cyclopropyl-5-(fluoromethyl)thiadiazole has a molecular weight of 158.20 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-5-(fluoromethyl)thiadiazole is sourced from PubChem (CID 141237817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).