4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole

C82H118N24O2S2 — CID 159332239

About 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole

4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole (PubChem CID 159332239) has the molecular formula C82H118N24O2S2 and a molecular weight of 1536.15 g/mol. Its IUPAC name is 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole.

Molecular Properties

• Compound Name: 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole
• PubChem CID: 159332239
• Molecular Formula: C82H118N24O2S2
• Molecular Weight: 1536.15 g/mol
• Exact Mass: 1534.93
• IUPAC Name: 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole
• SMILES: Cc1cccnc1C.Cc1cccnc1C.Cc1ccncc1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cncnc1C.Cc1cncnc1C.Cc1n[nH]nc1C.Cc1nc[nH]c1C.Cc1ncoc1C.Cc1ncoc1C.Cc1ncsc1C.Cc1ncsc1C
• InChI: InChI=1S/3C7H9N.2C6H8N2.5C5H8N2.2C5H7NO.2C5H7NS.C4H7N3/c1-6-3-4-8-5-7(6)2;2*1-6-4-3-5-8-7(6)2;2*1-5-3-7-4-8-6(5)2;1-4-5(2)7-3-6-4;4*1-4-3-6-7-5(4)2;4*1-4-5(2)7-3-6-4;1-3-4(2)6-7-5-3/h3*3-5H,1-2H3;2*3-4H,1-2H3;5*3H,1-2H3,(H,6,7);4*3H,1-2H3;1-2H3,(H,5,6,7)
• InChIKey: LFCHMCFXGWZVHH-UHFFFAOYSA-N
• XLogP: 18.94
• TPSA: 353.04 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 22
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1536.15
LogP ≤ 5	18.94
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole?

The IUPAC name of 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole (CID 159332239) is 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole.

What is the SMILES notation for 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole?

The canonical SMILES for 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole is Cc1cccnc1C.Cc1cccnc1C.Cc1ccncc1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cncnc1C.Cc1cncnc1C.Cc1n[nH]nc1C.Cc1nc[nH]c1C.Cc1ncoc1C.Cc1ncoc1C.Cc1ncsc1C.Cc1ncsc1C.

What is the InChIKey of 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole?

The InChIKey is LFCHMCFXGWZVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/3C7H9N.2C6H8N2.5C5H8N2.2C5H7NO.2C5H7NS.C4H7N3/c1-6-3-4-8-5-7(6)2;2*1-6-4-3-5-8-7(6)2;2*1-5-3-7-4-8-6(5)2;1-4-5(2)7-3-6-4;4*1-4-3-6-7-5(4)2;4*1-4-5(2)7-3-6-4;1-3-4(2)6-7-5-3/h3*3-5H,1-2H3;2*3-4H,1-2H3;5*3H,1-2H3,(H,6,7);4*3H,1-2H3;1-2H3,(H,5,6,7).

What are the key properties of 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole?

4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole has a molecular weight of 1536.15 g/mol, XLogP of 18.94, 0 rotatable bonds, 6 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 4,5-dimethyl-1H-imidazole;bis(4,5-dimethyl-1,3-oxazole);tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);3,4-dimethylpyridine;bis(4,5-dimethylpyrimidine);bis(4,5-dimethyl-1,3-thiazole);4,5-dimethyl-2H-triazole is sourced from PubChem (CID 159332239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).