2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole

C9H9N3O — CID 131089626

IUPAC2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole
SMILESCc1nnc(-c2cccnc2C)o1
InChIInChI=1S/C9H9N3O/c1-6-8(4-3-5-10-6)9-12-11-7(2)13-9/h3-5H,1-2H3
InChIKeyVRUDYMFLUMCVBK-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.75
Rot. Bonds1

About 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole

2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole (PubChem CID 131089626) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole
PubChem CID131089626
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole
SMILESCc1nnc(-c2cccnc2C)o1
InChIInChI=1S/C9H9N3O/c1-6-8(4-3-5-10-6)9-12-11-7(2)13-9/h3-5H,1-2H3
InChIKeyVRUDYMFLUMCVBK-UHFFFAOYSA-N
XLogP1.75
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-methyl-3-pyridinyl)-N-phenyl-1,3,4-oxadiazol-2-amine
CID 143729405
4-[3-(5-methyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazine-1-carboxylic acid
CID 139512630
N-methyl-3-(5-methyl-1,3,4-oxadiazol-2-yl)-2-methylsulfanylaniline
CID 167031329
2-methyl-5-pyridin-3-yl-1,3,4-oxadiazole
CID 5052252
1-[5-(2-methyl-3-pyridinyl)-1,2,4-oxadiazol-3-yl]ethanol
CID 102660795
[2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]methanol
CID 56709300
2-(2-methoxy-3-pyridinyl)-5-(4-methylpyrimidin-5-yl)-1,3,4-oxadiazole
CID 99962939
2-(2-fluoro-6-pyrimidin-4-ylphenyl)-5-methyl-1,3,4-oxadiazole
CID 145311662
1-chloro-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanesulfonamide
CID 63666407
3-(3,5-dichlorophenyl)-2-methylpyridine
CID 90167646
1-bromo-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanesulfonamide
CID 83084278
2-(2-methylphenyl)-5-pyridin-2-yl-1,3,4-oxadiazole
CID 15957151

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole?
The IUPAC name of 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole (CID 131089626) is 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole is Cc1nnc(-c2cccnc2C)o1.
What is the InChIKey of 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole?
The InChIKey is VRUDYMFLUMCVBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-6-8(4-3-5-10-6)9-12-11-7(2)13-9/h3-5H,1-2H3.
What are the key properties of 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole?
2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole has a molecular weight of 175.19 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole is sourced from PubChem (CID 131089626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).