2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine

C43H67N13O6 — CID 160630740

About 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine

2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine (PubChem CID 160630740) has the molecular formula C43H67N13O6 and a molecular weight of 862.09 g/mol. Its IUPAC name is 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine.

Molecular Properties

• Compound Name: 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine
• PubChem CID: 160630740
• Molecular Formula: C43H67N13O6
• Molecular Weight: 862.09 g/mol
• Exact Mass: 861.53
• IUPAC Name: 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine
• SMILES: CC1=NC(C)C(C)O1.Cc1cc(C)on1.Cc1cnc(C)n1C.Cc1nc(C)c(C)o1.Cc1nc(C)c(C)o1.Cc1nc(C)nc(C)n1.Cc1nnc(C)o1.Cc1noc(C)n1
• InChI: InChI=1S/C6H9N3.C6H10N2.C6H11NO.2C6H9NO.C5H7NO.2C4H6N2O/c1-4-7-5(2)9-6(3)8-4;1-5-4-7-6(2)8(5)3;3*1-4-5(2)8-6(3)7-4;1-4-3-5(2)7-6-4;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3/h1-3H3;4H,1-3H3;4-5H,1-3H3;2*1-3H3;3H,1-2H3;2*1-2H3
• InChIKey: RHWXOYCHTDJTLR-UHFFFAOYSA-N
• XLogP: 8.91
• TPSA: 234.01 Ų
• H-Bond Acceptors: 19
• Heavy Atoms: 62
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	862.09
LogP ≤ 5	8.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine?

The IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine (CID 160630740) is 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine.

What is the SMILES notation for 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine?

The canonical SMILES for 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine is CC1=NC(C)C(C)O1.Cc1cc(C)on1.Cc1cnc(C)n1C.Cc1nc(C)c(C)o1.Cc1nc(C)c(C)o1.Cc1nc(C)nc(C)n1.Cc1nnc(C)o1.Cc1noc(C)n1.

What is the InChIKey of 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine?

The InChIKey is RHWXOYCHTDJTLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3.C6H10N2.C6H11NO.2C6H9NO.C5H7NO.2C4H6N2O/c1-4-7-5(2)9-6(3)8-4;1-5-4-7-6(2)8(5)3;3*1-4-5(2)8-6(3)7-4;1-4-3-5(2)7-6-4;1-3-5-6-4(2)7-3;1-3-5-4(2)7-6-3/h1-3H3;4H,1-3H3;4-5H,1-3H3;2*1-3H3;3H,1-2H3;2*1-2H3.

What are the key properties of 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine?

2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine has a molecular weight of 862.09 g/mol, XLogP of 8.91, 0 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-dimethyl-1,3,4-oxadiazole;3,5-dimethyl-1,2,4-oxadiazole;3,5-dimethyl-1,2-oxazole;2,4,5-trimethyl-4,5-dihydro-1,3-oxazole;1,2,5-trimethylimidazole;bis(2,4,5-trimethyl-1,3-oxazole);2,4,6-trimethyl-1,3,5-triazine is sourced from PubChem (CID 160630740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).