1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole

C56H83N27O4S4 — CID 157470951

About 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole

1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole (PubChem CID 157470951) has the molecular formula C56H83N27O4S4 and a molecular weight of 1326.73 g/mol. Its IUPAC name is 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole.

Molecular Properties

• Compound Name: 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole
• PubChem CID: 157470951
• Molecular Formula: C56H83N27O4S4
• Molecular Weight: 1326.73 g/mol
• Exact Mass: 1325.60
• IUPAC Name: 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole
• SMILES: Cc1cc(C)[nH]n1.Cc1cn(C)cn1.Cc1cnc(C)[nH]1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1cocn1.Cc1cscn1.Cc1n[nH]c(C)n1.Cc1ncn(C)n1.Cc1ncn[nH]1.Cc1ncno1.Cc1ncns1.Cc1ncon1.Cc1ncsn1
• InChI: InChI=1S/3C5H8N2.C5H7NO.C5H7NS.2C4H7N3.C4H5NO.C4H5NS.C3H5N3.2C3H4N2O.2C3H4N2S/c1-5-3-7(2)4-6-5;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;2*1-4-3-6-5(2)7-4;1-4-5-3-7(2)6-4;1-3-5-4(2)7-6-3;2*1-4-2-6-3-5-4;1-3-4-2-5-6-3;1-3-4-2-6-5-3;1-3-4-2-5-6-3;1-3-4-2-6-5-3;1-3-4-2-5-6-3/h3-4H,1-2H3;2*3H,1-2H3,(H,6,7);3*3H,1-2H3;1-2H3,(H,5,6,7);2*2-3H,1H3;2H,1H3,(H,4,5,6);4*2H,1H3
• InChIKey: BVALFFSMSIABIF-UHFFFAOYSA-N
• XLogP: 11.37
• TPSA: 396.27 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1326.73
LogP ≤ 5	11.37
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole?

The IUPAC name of 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole (CID 157470951) is 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole.

What is the SMILES notation for 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole?

The canonical SMILES for 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole is Cc1cc(C)[nH]n1.Cc1cn(C)cn1.Cc1cnc(C)[nH]1.Cc1cnc(C)o1.Cc1cnc(C)s1.Cc1cocn1.Cc1cscn1.Cc1n[nH]c(C)n1.Cc1ncn(C)n1.Cc1ncn[nH]1.Cc1ncno1.Cc1ncns1.Cc1ncon1.Cc1ncsn1.

What is the InChIKey of 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole?

The InChIKey is BVALFFSMSIABIF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H8N2.C5H7NO.C5H7NS.2C4H7N3.C4H5NO.C4H5NS.C3H5N3.2C3H4N2O.2C3H4N2S/c1-5-3-7(2)4-6-5;1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;2*1-4-3-6-5(2)7-4;1-4-5-3-7(2)6-4;1-3-5-4(2)7-6-3;2*1-4-2-6-3-5-4;1-3-4-2-5-6-3;1-3-4-2-6-5-3;1-3-4-2-5-6-3;1-3-4-2-6-5-3;1-3-4-2-5-6-3/h3-4H,1-2H3;2*3H,1-2H3,(H,6,7);3*3H,1-2H3;1-2H3,(H,5,6,7);2*2-3H,1H3;2H,1H3,(H,4,5,6);4*2H,1H3.

What are the key properties of 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole?

1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole has a molecular weight of 1326.73 g/mol, XLogP of 11.37, 0 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 1,4-dimethylimidazole;2,5-dimethyl-1H-imidazole;2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1H-pyrazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3,5-dimethyl-1H-1,2,4-triazole;3-methyl-1,2,4-oxadiazole;5-methyl-1,2,4-oxadiazole;4-methyl-1,3-oxazole;3-methyl-1,2,4-thiadiazole;5-methyl-1,2,4-thiadiazole;4-methyl-1,3-thiazole;5-methyl-1H-1,2,4-triazole is sourced from PubChem (CID 157470951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).