bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole

C59H82N12O6S4 — CID 162174901

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

bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole (PubChem CID 162174901) has the molecular formula C59H82N12O6S4 and a molecular weight of 1183.65 g/mol. Its IUPAC name is bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole.

Molecular Properties

• Compound Name: bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole
• PubChem CID: 162174901
• Molecular Formula: C59H82N12O6S4
• Molecular Weight: 1183.65 g/mol
• Exact Mass: 1182.54
• IUPAC Name: bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole
• SMILES: Cc1cc(C)n(C)c1.Cc1cc(C)on1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1ccc(C)n1C.Cc1ccno1.Cc1ccon1.Cc1ccsn1.Cc1cnoc1.Cc1cnoc1C.Cc1cnsc1.Cc1cnsc1C
• InChI: InChI=1S/2C7H11N.3C5H7NO.2C5H7NS.3C4H5NO.2C4H5NS/c1-6-4-7(2)8(3)5-6;1-6-4-5-7(2)8(6)3;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;1-4-3-5(2)7-6-4;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/h2*4-5H,1-3H3;5*3H,1-2H3;5*2-3H,1H3
• InChIKey: ZOGMBVLTAXLBMM-UHFFFAOYSA-N
• XLogP: 16.53
• TPSA: 217.60 Ų
• H-Bond Acceptors: 22
• Heavy Atoms: 81
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1183.65
LogP ≤ 5	16.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

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

The IUPAC name of bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole (CID 162174901) is bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole.

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

The canonical SMILES for bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole is Cc1cc(C)n(C)c1.Cc1cc(C)on1.Cc1cc(C)on1.Cc1cc(C)sn1.Cc1ccc(C)n1C.Cc1ccno1.Cc1ccon1.Cc1ccsn1.Cc1cnoc1.Cc1cnoc1C.Cc1cnsc1.Cc1cnsc1C.

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

The InChIKey is ZOGMBVLTAXLBMM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H11N.3C5H7NO.2C5H7NS.3C4H5NO.2C4H5NS/c1-6-4-7(2)8(3)5-6;1-6-4-5-7(2)8(6)3;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;1-4-3-5(2)7-6-4;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/h2*4-5H,1-3H3;5*3H,1-2H3;5*2-3H,1H3.

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

bis(3,5-dimethyl-1,2-oxazole);4,5-dimethyl-1,2-oxazole;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole has a molecular weight of 1183.65 g/mol, XLogP of 16.53, 0 rotatable bonds, 0 hydrogen bond donors, and 22 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;3,5-dimethyl-1,2-thiazole;4,5-dimethyl-1,2-thiazole;3-methyl-1,2-oxazole;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;3-methyl-1,2-thiazole;4-methyl-1,2-thiazole;1,2,4-trimethylpyrrole;1,2,5-trimethylpyrrole is sourced from PubChem (CID 162174901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).