3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole

C14H16FN3OS — CID 43949506

IUPAC3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole
SMILESFc1ccc(COc2nsnc2N2CCCCC2)cc1
InChIInChI=1S/C14H16FN3OS/c15-12-6-4-11(5-7-12)10-19-14-13(16-20-17-14)18-8-2-1-3-9-18/h4-7H,1-3,8-10H2
InChIKeyXPJBXAHIAZXNKI-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.25
Rot. Bonds4

About 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole

3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole (PubChem CID 43949506) has the molecular formula C14H16FN3OS and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole.

Molecular Properties

Compound Name3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole
PubChem CID43949506
Molecular FormulaC14H16FN3OS
Molecular Weight293.37 g/mol
Exact Mass293.10
IUPAC Name3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole
SMILESFc1ccc(COc2nsnc2N2CCCCC2)cc1
InChIInChI=1S/C14H16FN3OS/c15-12-6-4-11(5-7-12)10-19-14-13(16-20-17-14)18-8-2-1-3-9-18/h4-7H,1-3,8-10H2
InChIKeyXPJBXAHIAZXNKI-UHFFFAOYSA-N
XLogP3.25
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole with MolForge

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

Launch Full Analysis

Related Compounds

4-(4-p-Tolyloxy-[1,2,5]thiadiazol-3-yl)-morpholine
CID 641399
4-[4-(Benzyloxy)-1,2,5-thiadiazol-3-yl]morpholine
CID 1088923
2-Fluorobenzyl 4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl ether
CID 16643986
3-(Azepan-1-yl)-4-[(4-fluorophenyl)methoxy]-1,2,5-thiadiazole
CID 43949442
3-(Azepan-1-yl)-4-[(2-chloro-6-fluorophenyl)methoxy]-1,2,5-thiadiazole
CID 43949456
3-(Azepan-1-yl)-4-[(2-fluorophenyl)methoxy]-1,2,5-thiadiazole
CID 43949465
3-(Azepan-1-yl)-4-[(3-fluorophenyl)methoxy]-1,2,5-thiadiazole
CID 43949468
3-[(4-Fluorophenyl)methoxy]-4-pyrrolidin-1-yl-1,2,5-thiadiazole
CID 43949474
3-[(2-Chloro-6-fluorophenyl)methoxy]-4-pyrrolidin-1-yl-1,2,5-thiadiazole
CID 43949488
3-[(2-Fluorophenyl)methoxy]-4-pyrrolidin-1-yl-1,2,5-thiadiazole
CID 43949497
3-[(3-Fluorophenyl)methoxy]-4-pyrrolidin-1-yl-1,2,5-thiadiazole
CID 43949500
3-[(2-Chloro-6-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole
CID 43949520

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole?
The IUPAC name of 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole (CID 43949506) is 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole.
What is the SMILES notation for 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole?
The canonical SMILES for 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole is Fc1ccc(COc2nsnc2N2CCCCC2)cc1.
What is the InChIKey of 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole?
The InChIKey is XPJBXAHIAZXNKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3OS/c15-12-6-4-11(5-7-12)10-19-14-13(16-20-17-14)18-8-2-1-3-9-18/h4-7H,1-3,8-10H2.
What are the key properties of 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole?
3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole has a molecular weight of 293.37 g/mol, XLogP of 3.25, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-fluorophenyl)methoxy]-4-piperidin-1-yl-1,2,5-thiadiazole is sourced from PubChem (CID 43949506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).