bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene

C206H369N33O7S7 — CID 161034766

About bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene

bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene (PubChem CID 161034766) has the molecular formula C206H369N33O7S7 and a molecular weight of 3644.91 g/mol. Its IUPAC name is bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene.

Molecular Properties

• Compound Name: bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene
• PubChem CID: 161034766
• Molecular Formula: C206H369N33O7S7
• Molecular Weight: 3644.91 g/mol
• Exact Mass: 3641.76
• IUPAC Name: bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.Cc1cc(C)n(C)c1.Cc1cc(C)n(C)c1.Cc1ccc(C)cc1.Cc1ccc(C)n1C.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc(C)nn1.Cc1ccc(C)o1.Cc1ccc(C)s1.Cc1cn(C)c(C)n1.Cc1cn(C)c(C)n1.Cc1cn(C)cn1.Cc1cnc(C)cn1.Cc1cnc(C)n1C.Cc1cnc(C)n1C.Cc1cnc(C)nc1.Cc1cnc(C)nc1.Cc1cnc(C)o1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1cnc(C)s1.Cc1cnn(C)c1.Cc1coc(C)c1.Cc1coc(C)c1.Cc1coc(C)n1.Cc1coc(C)n1.Cc1csc(C)c1.Cc1csc(C)c1.Cc1csc(C)n1.Cc1csc(C)n1
• InChI: InChI=1S/C8H10.3C7H11N.2C7H9N.4C6H10N2.4C6H8N2.3C6H8O.3C6H8S.2C5H8N2.4C5H7NO.4C5H7NS.29CH4/c1-7-3-5-8(2)6-4-7;2*1-6-4-7(2)8(3)5-6;1-6-4-5-7(2)8(6)3;2*1-6-3-4-7(2)8-5-6;2*1-5-4-8(3)6(2)7-5;2*1-5-4-7-6(2)8(5)3;1-5-3-8-6(2)4-7-5;2*1-5-3-7-6(2)8-4-5;1-5-3-4-6(2)8-7-5;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;1-5-3-7(2)4-6-5;1-5-3-6-7(2)4-5;2*1-4-3-7-5(2)6-4;2*1-4-3-6-5(2)7-4;2*1-4-3-7-5(2)6-4;2*1-4-3-6-5(2)7-4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3-6H,1-2H3;3*4-5H,1-3H3;2*3-5H,1-2H3;4*4H,1-3H3;4*3-4H,1-2H3;8*3-4H,1-2H3;8*3H,1-2H3;29*1H4
• InChIKey: UACKWIGPNNSMJK-UHFFFAOYSA-N
• XLogP: 64.04
• TPSA: 445.71 Ų
• H-Bond Acceptors: 47
• Heavy Atoms: 253
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3644.91
LogP ≤ 5	64.04
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	47

Frequently Asked Questions

What is the IUPAC name of bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene?

The IUPAC name of bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene (CID 161034766) is bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene.

What is the SMILES notation for bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene?

The canonical SMILES for bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.Cc1cc(C)n(C)c1.Cc1cc(C)n(C)c1.Cc1ccc(C)cc1.Cc1ccc(C)n1C.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc(C)nn1.Cc1ccc(C)o1.Cc1ccc(C)s1.Cc1cn(C)c(C)n1.Cc1cn(C)c(C)n1.Cc1cn(C)cn1.Cc1cnc(C)cn1.Cc1cnc(C)n1C.Cc1cnc(C)n1C.Cc1cnc(C)nc1.Cc1cnc(C)nc1.Cc1cnc(C)o1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1cnc(C)s1.Cc1cnn(C)c1.Cc1coc(C)c1.Cc1coc(C)c1.Cc1coc(C)n1.Cc1coc(C)n1.Cc1csc(C)c1.Cc1csc(C)c1.Cc1csc(C)n1.Cc1csc(C)n1.

What is the InChIKey of bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene?

The InChIKey is UACKWIGPNNSMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10.3C7H11N.2C7H9N.4C6H10N2.4C6H8N2.3C6H8O.3C6H8S.2C5H8N2.4C5H7NO.4C5H7NS.29CH4/c1-7-3-5-8(2)6-4-7;2*1-6-4-7(2)8(3)5-6;1-6-4-5-7(2)8(6)3;2*1-6-3-4-7(2)8-5-6;2*1-5-4-8(3)6(2)7-5;2*1-5-4-7-6(2)8(5)3;1-5-3-8-6(2)4-7-5;2*1-5-3-7-6(2)8-4-5;1-5-3-4-6(2)8-7-5;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;2*1-5-3-6(2)7-4-5;1-5-3-4-6(2)7-5;1-5-3-7(2)4-6-5;1-5-3-6-7(2)4-5;2*1-4-3-7-5(2)6-4;2*1-4-3-6-5(2)7-4;2*1-4-3-7-5(2)6-4;2*1-4-3-6-5(2)7-4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h3-6H,1-2H3;3*4-5H,1-3H3;2*3-5H,1-2H3;4*4H,1-3H3;4*3-4H,1-2H3;8*3-4H,1-2H3;8*3H,1-2H3;29*1H4.

What are the key properties of bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene?

bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene has a molecular weight of 3644.91 g/mol, XLogP of 64.04, 0 rotatable bonds, 0 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2,4-dimethylfuran);2,5-dimethylfuran;1,4-dimethylimidazole;bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);2,5-dimethylpyrazine;1,4-dimethylpyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;methane;bis(1,2,4-trimethylimidazole);bis(1,2,5-trimethylimidazole);bis(1,2,4-trimethylpyrrole);1,2,5-trimethylpyrrole;1,4-xylene is sourced from PubChem (CID 161034766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).