3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran

C66H97N9O4S4 — CID 161454782

About 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran

3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran (PubChem CID 161454782) has the molecular formula C66H97N9O4S4 and a molecular weight of 1208.83 g/mol. Its IUPAC name is 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran.

Molecular Properties

• Compound Name: 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran
• PubChem CID: 161454782
• Molecular Formula: C66H97N9O4S4
• Molecular Weight: 1208.83 g/mol
• Exact Mass: 1207.65
• IUPAC Name: 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran
• SMILES: C.CN1CCCC1.Cc1cc(C)c(C)o1.Cc1cc(C)on1.Cc1ccc(N2CCCCC2)nc1.Cc1ccccn1.Cc1ccco1.Cc1coc(C)c1C.Cc1csc(C)n1.Cc1csc(C)n1.Cc1nccs1.Cc1ncsc1C
• InChI: InChI=1S/C11H16N2.2C7H10O.C6H7N.C5H7NO.3C5H7NS.C5H11N.C5H6O.C4H5NS.CH4/c1-10-5-6-11(12-9-10)13-7-3-2-4-8-13;1-5-4-8-7(3)6(5)2;1-5-4-6(2)8-7(5)3;1-6-4-2-3-5-7-6;1-4-3-5(2)7-6-4;1-4-5(2)7-3-6-4;2*1-4-3-7-5(2)6-4;1-6-4-2-3-5-6;1-5-3-2-4-6-5;1-4-5-2-3-6-4;/h5-6,9H,2-4,7-8H2,1H3;2*4H,1-3H3;2-5H,1H3;4*3H,1-2H3;2-5H2,1H3;2-4H,1H3;2-3H,1H3;1H4
• InChIKey: WAZXVUSJWOHPET-UHFFFAOYSA-N
• XLogP: 19.14
• TPSA: 149.27 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 1
• Heavy Atoms: 83
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1208.83
LogP ≤ 5	19.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran?

The IUPAC name of 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran (CID 161454782) is 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran.

What is the SMILES notation for 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran?

The canonical SMILES for 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran is C.CN1CCCC1.Cc1cc(C)c(C)o1.Cc1cc(C)on1.Cc1ccc(N2CCCCC2)nc1.Cc1ccccn1.Cc1ccco1.Cc1coc(C)c1C.Cc1csc(C)n1.Cc1csc(C)n1.Cc1nccs1.Cc1ncsc1C.

What is the InChIKey of 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran?

The InChIKey is WAZXVUSJWOHPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2.2C7H10O.C6H7N.C5H7NO.3C5H7NS.C5H11N.C5H6O.C4H5NS.CH4/c1-10-5-6-11(12-9-10)13-7-3-2-4-8-13;1-5-4-8-7(3)6(5)2;1-5-4-6(2)8-7(5)3;1-6-4-2-3-5-7-6;1-4-3-5(2)7-6-4;1-4-5(2)7-3-6-4;2*1-4-3-7-5(2)6-4;1-6-4-2-3-5-6;1-5-3-2-4-6-5;1-4-5-2-3-6-4;/h5-6,9H,2-4,7-8H2,1H3;2*4H,1-3H3;2-5H,1H3;4*3H,1-2H3;2-5H2,1H3;2-4H,1H3;2-3H,1H3;1H4.

What are the key properties of 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran?

3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran has a molecular weight of 1208.83 g/mol, XLogP of 19.14, 1 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);4,5-dimethyl-1,3-thiazole;methane;2-methylfuran;5-methyl-2-piperidin-1-ylpyridine;2-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,3,4-trimethylfuran;2,3,5-trimethylfuran is sourced from PubChem (CID 161454782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).