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

C12H9N5O — CID 99962926

IUPAC2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole
SMILESCc1ncncc1-c1nnc(-c2ccccn2)o1
InChIInChI=1S/C12H9N5O/c1-8-9(6-13-7-15-8)11-16-17-12(18-11)10-4-2-3-5-14-10/h2-7H,1H3
InChIKeyLISNJDYYDXRJKS-UHFFFAOYSA-N
MW239.24 g/mol
LogP1.90
Rot. Bonds2

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

2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole (PubChem CID 99962926) has the molecular formula C12H9N5O and a molecular weight of 239.24 g/mol. Its IUPAC name is 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole
PubChem CID99962926
Molecular FormulaC12H9N5O
Molecular Weight239.24 g/mol
Exact Mass239.08
IUPAC Name2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole
SMILESCc1ncncc1-c1nnc(-c2ccccn2)o1
InChIInChI=1S/C12H9N5O/c1-8-9(6-13-7-15-8)11-16-17-12(18-11)10-4-2-3-5-14-10/h2-7H,1H3
InChIKeyLISNJDYYDXRJKS-UHFFFAOYSA-N
XLogP1.90
TPSA77.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.24
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2-methylphenyl)-5-pyridin-2-yl-1,3,4-oxadiazole
CID 15957151
2-(4-methylpyrimidin-5-yl)-5-pyridin-3-yl-1,3,4-oxadiazole
CID 99962927
2-(2-methoxy-3-pyridinyl)-5-(4-methylpyrimidin-5-yl)-1,3,4-oxadiazole
CID 99962939
2-(6-pyridin-2-yl-2-pyridinyl)-5-[6-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]-1,3,4-oxadiazole
CID 59514881
4-chloro-5-pyridin-2-ylpyrimidine
CID 105371145
2-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-5-(4-methylpyrimidin-5-yl)-1,3,4-oxadiazole
CID 99962935
2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole
CID 131089626
ethane;4-methyl-3-pyridin-2-ylpyridine
CID 143216291
2-(6-pyridin-2-yl-2-pyridinyl)-5-[4-[5-(6-pyridin-2-yl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
CID 59236802
6-(4-methylpyrimidin-5-yl)pyridin-2-amine
CID 82405870
2,5-dipyridin-2-yl-1,3-oxazole
CID 67299050
2-benzyl-5-pyridin-2-yl-1,3,4-oxadiazole
CID 156786960

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole?
The IUPAC name of 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole (CID 99962926) is 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole is Cc1ncncc1-c1nnc(-c2ccccn2)o1.
What is the InChIKey of 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole?
The InChIKey is LISNJDYYDXRJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N5O/c1-8-9(6-13-7-15-8)11-16-17-12(18-11)10-4-2-3-5-14-10/h2-7H,1H3.
What are the key properties of 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole?
2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole has a molecular weight of 239.24 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpyrimidin-5-yl)-5-pyridin-2-yl-1,3,4-oxadiazole is sourced from PubChem (CID 99962926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).