5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole

C10H13N5OS — CID 60917230

IUPAC5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole
SMILESCc1nnsc1-c1nc(C2CCCCN2)no1
InChIInChI=1S/C10H13N5OS/c1-6-8(17-15-13-6)10-12-9(14-16-10)7-4-2-3-5-11-7/h7,11H,2-5H2,1H3
InChIKeyQXBZUSXTIBAKDQ-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.71
Rot. Bonds2

About 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole

5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole (PubChem CID 60917230) has the molecular formula C10H13N5OS and a molecular weight of 251.31 g/mol. Its IUPAC name is 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole
PubChem CID60917230
Molecular FormulaC10H13N5OS
Molecular Weight251.31 g/mol
Exact Mass251.08
IUPAC Name5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole
SMILESCc1nnsc1-c1nc(C2CCCCN2)no1
InChIInChI=1S/C10H13N5OS/c1-6-8(17-15-13-6)10-12-9(14-16-10)7-4-2-3-5-11-7/h7,11H,2-5H2,1H3
InChIKeyQXBZUSXTIBAKDQ-UHFFFAOYSA-N
XLogP1.71
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole (CID 60917230) is 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole is Cc1nnsc1-c1nc(C2CCCCN2)no1.
What is the InChIKey of 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole?
The InChIKey is QXBZUSXTIBAKDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5OS/c1-6-8(17-15-13-6)10-12-9(14-16-10)7-4-2-3-5-11-7/h7,11H,2-5H2,1H3.
What are the key properties of 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole?
5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole has a molecular weight of 251.31 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylthiadiazol-5-yl)-3-piperidin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 60917230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).