2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole

C₇₀H₁₃₂N₁₈O₄S₃ — CID 158002348

About 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole

2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole (PubChem CID 158002348) has the molecular formula C₇₀H₁₃₂N₁₈O₄S₃ and a molecular weight of 1386.15 g/mol. Its IUPAC name is 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole.

Molecular Properties

• Compound Name: 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole
• PubChem CID: 158002348
• Molecular Formula: C₇₀H₁₃₂N₁₈O₄S₃
• Molecular Weight: 1386.15 g/mol
• Exact Mass: 1384.98
• IUPAC Name: 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccn[nH]1.Cc1ccn[nH]1.Cc1ccno1.Cc1ccns1.Cc1ccon1.Cc1ccsn1.Cc1cn[nH]c1.Cc1cnc[nH]1.Cc1cnoc1.Cc1cnsc1.Cc1nnc(C)o1.Cn1cccn1
• InChI: InChI=1S/C4H6N2O.5C4H6N2.3C4H5NO.3C4H5NS.11C2H6/c1-3-5-6-4(2)7-3;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-6-4-2-3-5-6;2*1-4-2-3-5-6-4;1-4-2-5-6-3-4;1-4-2-3-6-5-4;1-4-2-3-5-6-4;1-4-2-5-6-3-4;1-4-2-3-6-5-4;1-4-2-3-5-6-4;11*1-2/h1-2H3;2*2-3H,1H3,(H,5,6);2-4H,1H3;2*2-3H,1H3,(H,5,6);6*2-3H,1H3;11*1-2H3
• InChIKey: FDWPVZXFKCTBRW-UHFFFAOYSA-N
• XLogP: 22.57
• TPSA: 288.22 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Heavy Atoms: 95
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1386.15
LogP ≤ 5	22.57
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

The IUPAC name of 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole (CID 158002348) is 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole.

What is the SMILES notation for 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

The canonical SMILES for 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccn[nH]1.Cc1ccn[nH]1.Cc1ccno1.Cc1ccns1.Cc1ccon1.Cc1ccsn1.Cc1cn[nH]c1.Cc1cnc[nH]1.Cc1cnoc1.Cc1cnsc1.Cc1nnc(C)o1.Cn1cccn1.

What is the InChIKey of 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

The InChIKey is FDWPVZXFKCTBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O.5C4H6N2.3C4H5NO.3C4H5NS.11C2H6/c1-3-5-6-4(2)7-3;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-6-4-2-3-5-6;2*1-4-2-3-5-6-4;1-4-2-5-6-3-4;1-4-2-3-6-5-4;1-4-2-3-5-6-4;1-4-2-5-6-3-4;1-4-2-3-6-5-4;1-4-2-3-5-6-4;11*1-2/h1-2H3;2*2-3H,1H3,(H,5,6);2-4H,1H3;2*2-3H,1H3,(H,5,6);6*2-3H,1H3;11*1-2H3.

What are the key properties of 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole?

2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole has a molecular weight of 1386.15 g/mol, XLogP of 22.57, 0 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-dimethyl-1,3,4-oxadiazole;ethane;5-methyl-1H-imidazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;1-methylpyrazole;4-methyl-1H-pyrazole;bis(5-methyl-1H-pyrazole);3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;5-methyl-1,2-thiazole is sourced from PubChem (CID 158002348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158002348 — identifiers, structure, computed properties (public domain)

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