3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole

C7H10FN3S — CID 141352817

IUPAC3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole
SMILESFC1CCN(c2ncsn2)CC1
InChIInChI=1S/C7H10FN3S/c8-6-1-3-11(4-2-6)7-9-5-12-10-7/h5-6H,1-4H2
InChIKeyQJWGBWMATOLELQ-UHFFFAOYSA-N
MW187.24 g/mol
LogP1.48
Rot. Bonds1

About 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole

3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole (PubChem CID 141352817) has the molecular formula C7H10FN3S and a molecular weight of 187.24 g/mol. Its IUPAC name is 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole.

Molecular Properties

Compound Name3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole
PubChem CID141352817
Molecular FormulaC7H10FN3S
Molecular Weight187.24 g/mol
Exact Mass187.06
IUPAC Name3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole
SMILESFC1CCN(c2ncsn2)CC1
InChIInChI=1S/C7H10FN3S/c8-6-1-3-11(4-2-6)7-9-5-12-10-7/h5-6H,1-4H2
InChIKeyQJWGBWMATOLELQ-UHFFFAOYSA-N
XLogP1.48
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-(Trifluoromethyl)piperidin-1-yl]-1,2,4-thiadiazole
CID 71221271
3-[4-(Trifluoromethyl)piperidin-1-yl]-1,2,4-thiadiazole
CID 141352814
3-(4,4-Difluoropiperidin-1-yl)-1,2,4-thiadiazole
CID 141352816
3-(4-Butylpiperazin-1-yl)-1,2,4-thiadiazole
CID 23303067
5-Chloro-3-(piperidin-1-yl)-1,2,4-thiadiazole
CID 65267142
5-(4-Methylpiperidin-1-yl)-1,2,4-thiadiazole
CID 89002903
5-(3,5-Dimethylpiperidin-1-yl)-1,2,4-thiadiazole
CID 89385947
5-Piperidin-1-yl-1,2,4-thiadiazole
CID 90942214
3-Chloro-5-piperidin-1-yl-1,2,4-thiadiazole
CID 131108839
3-Piperidin-1-yl-1,2,4-thiadiazole
CID 175948156
5-(4-Chloropiperidin-1-yl)-1,2,4-thiadiazole
CID 65277685
5-(3-Bromopiperidin-1-yl)-1,2,4-thiadiazole
CID 80672029

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole?
The IUPAC name of 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole (CID 141352817) is 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole.
What is the SMILES notation for 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole?
The canonical SMILES for 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole is FC1CCN(c2ncsn2)CC1.
What is the InChIKey of 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole?
The InChIKey is QJWGBWMATOLELQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3S/c8-6-1-3-11(4-2-6)7-9-5-12-10-7/h5-6H,1-4H2.
What are the key properties of 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole?
3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole has a molecular weight of 187.24 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoropiperidin-1-yl)-1,2,4-thiadiazole is sourced from PubChem (CID 141352817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).