5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole

C13H13N5O — CID 71689313

IUPAC5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole
SMILESCCn1nc(C)cc1-c1nc(-c2ccccn2)no1
InChIInChI=1S/C13H13N5O/c1-3-18-11(8-9(2)16-18)13-15-12(17-19-13)10-6-4-5-7-14-10/h4-8H,3H2,1-2H3
InChIKeyOLOSHXZRXGKGTM-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.32
Rot. Bonds3

About 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole

5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole (PubChem CID 71689313) has the molecular formula C13H13N5O and a molecular weight of 255.28 g/mol. Its IUPAC name is 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole
PubChem CID71689313
Molecular FormulaC13H13N5O
Molecular Weight255.28 g/mol
Exact Mass255.11
IUPAC Name5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole
SMILESCCn1nc(C)cc1-c1nc(-c2ccccn2)no1
InChIInChI=1S/C13H13N5O/c1-3-18-11(8-9(2)16-18)13-15-12(17-19-13)10-6-4-5-7-14-10/h4-8H,3H2,1-2H3
InChIKeyOLOSHXZRXGKGTM-UHFFFAOYSA-N
XLogP2.32
TPSA69.63 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The IUPAC name of 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole (CID 71689313) is 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole.
What is the SMILES notation for 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The canonical SMILES for 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole is CCn1nc(C)cc1-c1nc(-c2ccccn2)no1.
What is the InChIKey of 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole?
The InChIKey is OLOSHXZRXGKGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5O/c1-3-18-11(8-9(2)16-18)13-15-12(17-19-13)10-6-4-5-7-14-10/h4-8H,3H2,1-2H3.
What are the key properties of 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole?
5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole has a molecular weight of 255.28 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethyl-5-methylpyrazol-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole is sourced from PubChem (CID 71689313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).