5-piperidin-1-yl-1,2,4-thiadiazole

C7H11N3S — CID 90942214

IUPAC5-piperidin-1-yl-1,2,4-thiadiazole
SMILESc1nsc(N2CCCCC2)n1
InChIInChI=1S/C7H11N3S/c1-2-4-10(5-3-1)7-8-6-9-11-7/h6H,1-5H2
InChIKeyRCHWEMITFMJJNQ-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.53
Rot. Bonds1

About 5-piperidin-1-yl-1,2,4-thiadiazole

5-piperidin-1-yl-1,2,4-thiadiazole (PubChem CID 90942214) has the molecular formula C7H11N3S and a molecular weight of 169.25 g/mol. Its IUPAC name is 5-piperidin-1-yl-1,2,4-thiadiazole.

Molecular Properties

Compound Name5-piperidin-1-yl-1,2,4-thiadiazole
PubChem CID90942214
Molecular FormulaC7H11N3S
Molecular Weight169.25 g/mol
Exact Mass169.07
IUPAC Name5-piperidin-1-yl-1,2,4-thiadiazole
SMILESc1nsc(N2CCCCC2)n1
InChIInChI=1S/C7H11N3S/c1-2-4-10(5-3-1)7-8-6-9-11-7/h6H,1-5H2
InChIKeyRCHWEMITFMJJNQ-UHFFFAOYSA-N
XLogP1.53
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.53
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-Fluoropiperidin-1-yl)-1,2,4-thiadiazole
CID 141352817
N,N-dibutyl-5-piperidin-1-yl-1,2,4-thiadiazol-3-amine
CID 321849
3-(4-Butylpiperazin-1-yl)-1,2,4-thiadiazole
CID 23303067
3-Pyrrolidin-1-yl-1,2,4-thiadiazole
CID 23303092
1-(1,2,4-Thiadiazol-5-yl)piperidin-4-one
CID 59433223
5-(4-Propan-2-ylpiperidin-1-yl)-1,2,4-thiadiazole
CID 59598934
5-Chloro-3-(piperidin-1-yl)-1,2,4-thiadiazole
CID 65267142
5-(4-Piperidin-1-ylpiperidin-1-yl)-1,2,4-thiadiazole
CID 70902011
5-(4-Methylpiperidin-1-yl)-1,2,4-thiadiazole
CID 89002903

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-1-yl-1,2,4-thiadiazole?
The IUPAC name of 5-piperidin-1-yl-1,2,4-thiadiazole (CID 90942214) is 5-piperidin-1-yl-1,2,4-thiadiazole.
What is the SMILES notation for 5-piperidin-1-yl-1,2,4-thiadiazole?
The canonical SMILES for 5-piperidin-1-yl-1,2,4-thiadiazole is c1nsc(N2CCCCC2)n1.
What is the InChIKey of 5-piperidin-1-yl-1,2,4-thiadiazole?
The InChIKey is RCHWEMITFMJJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3S/c1-2-4-10(5-3-1)7-8-6-9-11-7/h6H,1-5H2.
What are the key properties of 5-piperidin-1-yl-1,2,4-thiadiazole?
5-piperidin-1-yl-1,2,4-thiadiazole has a molecular weight of 169.25 g/mol, XLogP of 1.53, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-1-yl-1,2,4-thiadiazole is sourced from PubChem (CID 90942214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).