bis(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)

C83H119N23O2S2 — CID 159230988

About bis(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)

bis(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) (PubChem CID 159230988) has the molecular formula C83H119N23O2S2 and a molecular weight of 1535.16 g/mol. Its IUPAC name is bis(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).

Molecular Properties

• Compound Name: bis(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)
• PubChem CID: 159230988
• Molecular Formula: C83H119N23O2S2
• Molecular Weight: 1535.16 g/mol
• Exact Mass: 1533.94
• IUPAC Name: bis(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)
• SMILES: Cc1cccnc1C.Cc1cccnc1C.Cc1ccncc1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cncnc1C.Cc1cncnc1C.Cc1nc[nH]c1C.Cc1nc[nH]c1C.Cc1ncoc1C.Cc1ncoc1C.Cc1ncsc1C.Cc1ncsc1C
• InChI: InChI=1S/3C7H9N.2C6H8N2.6C5H8N2.2C5H7NO.2C5H7NS/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;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/h3*3-5H,1-2H3;2*3-4H,1-2H3;6*3H,1-2H3,(H,6,7);4*3H,1-2H3
• InChIKey: KSWWDSNDQVCOPF-UHFFFAOYSA-N
• XLogP: 19.54
• TPSA: 340.15 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 21
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1535.16
LogP ≤ 5	19.54
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of bis(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)?

The IUPAC name of bis(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) (CID 159230988) is bis(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).

What is the SMILES notation for bis(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)?

The canonical SMILES for bis(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) is Cc1cccnc1C.Cc1cccnc1C.Cc1ccncc1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cn[nH]c1C.Cc1cncnc1C.Cc1cncnc1C.Cc1nc[nH]c1C.Cc1nc[nH]c1C.Cc1ncoc1C.Cc1ncoc1C.Cc1ncsc1C.Cc1ncsc1C.

What is the InChIKey of bis(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)?

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

What are the key properties of bis(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)?

bis(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) has a molecular weight of 1535.16 g/mol, XLogP of 19.54, 0 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for bis(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) is sourced from PubChem (CID 159230988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).