Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole

C₅₅H₇₆N₁₄O₅S₅ — CID 159613608

About Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole

Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole (PubChem CID 159613608) has the molecular formula C₅₅H₇₆N₁₄O₅S₅ and a molecular weight of 1173.64 g/mol. Its IUPAC name is bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole.

Molecular Properties

• Compound Name: Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole
• PubChem CID: 159613608
• Molecular Formula: C₅₅H₇₆N₁₄O₅S₅
• Molecular Weight: 1173.64 g/mol
• Exact Mass: 1172.47
• IUPAC Name: bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole
• SMILES: Cc1cc(C)on1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1cc(C)sn1.Cc1ccn(C)n1.Cc1ccno1.Cc1ccns1.Cc1ccsn1.Cc1cnoc1.Cc1cnoc1C.Cc1cnsc1C.Cn1cccn1
• InChI: InChI=1S/C5H8N2.3C5H7NO.3C5H7NS.C4H6N2.2C4H5NO.2C4H5NS/c1-5-3-4-7(2)6-5;1-4-3-6-7-5(4)2;2*1-4-3-5(2)7-6-4;1-4-3-6-7-5(4)2;2*1-4-3-5(2)7-6-4;1-6-4-2-3-5-6;1-4-2-5-6-3-4;1-4-2-3-5-6-4;1-4-2-3-6-5-4;1-4-2-3-5-6-4/h3-4H,1-2H3;6*3H,1-2H3;2-4H,1H3;4*2-3H,1H3
• InChIKey: MMZYJNHEAOZYCX-UHFFFAOYSA-N
• XLogP: 15.17
• TPSA: 230.24 Ų
• H-Bond Acceptors: 24
• Heavy Atoms: 79
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1173.64
LogP ≤ 5	15.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Frequently Asked Questions

What is the IUPAC name of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

The IUPAC name of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole (CID 159613608) is bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole.

What is the SMILES notation for Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

The canonical SMILES for Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole is Cc1cc(C)on1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1cc(C)sn1.Cc1ccn(C)n1.Cc1ccno1.Cc1ccns1.Cc1ccsn1.Cc1cnoc1.Cc1cnoc1C.Cc1cnsc1C.Cn1cccn1.

What is the InChIKey of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

The InChIKey is MMZYJNHEAOZYCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.3C5H7NO.3C5H7NS.C4H6N2.2C4H5NO.2C4H5NS/c1-5-3-4-7(2)6-5;1-4-3-6-7-5(4)2;2*1-4-3-5(2)7-6-4;1-4-3-6-7-5(4)2;2*1-4-3-5(2)7-6-4;1-6-4-2-3-5-6;1-4-2-5-6-3-4;1-4-2-3-5-6-4;1-4-2-3-6-5-4;1-4-2-3-5-6-4/h3-4H,1-2H3;6*3H,1-2H3;2-4H,1H3;4*2-3H,1H3.

What are the key properties of Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole has a molecular weight of 1173.64 g/mol, XLogP of 15.17, 0 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for Bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;1,3-dimethylpyrazole;bis(3,5-dimethyl-1,2-thiazole);4,5-dimethyl-1,2-thiazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;3-methyl-1,2-thiazole;5-methyl-1,2-thiazole is sourced from PubChem (CID 159613608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159613608 — identifiers, structure, computed properties (public domain)

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