3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)

C51H73N15O2S2 — CID 158371335

About 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)

3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine) (PubChem CID 158371335) has the molecular formula C51H73N15O2S2 and a molecular weight of 992.38 g/mol. Its IUPAC name is 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine).

Molecular Properties

• Compound Name: 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)
• PubChem CID: 158371335
• Molecular Formula: C51H73N15O2S2
• Molecular Weight: 992.38 g/mol
• Exact Mass: 991.55
• IUPAC Name: 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)
• SMILES: C.CCc1nnc(C)s1.Cc1cc(C)nc(C)n1.Cc1cc(C)nc(C)n1.Cc1cc(C)on1.Cc1ccccn1.Cc1ccnc(C)n1.Cc1ncccn1.Cc1nncs1.Cc1noc(C)c1C
• InChI: InChI=1S/2C7H10N2.C6H8N2.C6H9NO.C6H7N.C5H8N2S.C5H6N2.C5H7NO.C3H4N2S.CH4/c2*1-5-4-6(2)9-7(3)8-5;1-5-3-4-7-6(2)8-5;1-4-5(2)7-8-6(4)3;1-6-4-2-3-5-7-6;1-3-5-7-6-4(2)8-5;1-5-6-3-2-4-7-5;1-4-3-5(2)7-6-4;1-3-5-4-2-6-3;/h2*4H,1-3H3;3-4H,1-2H3;1-3H3;2-5H,1H3;3H2,1-2H3;2-4H,1H3;3H,1-2H3;2H,1H3;1H4
• InChIKey: GUQMZTUWIOYSJU-UHFFFAOYSA-N
• XLogP: 11.86
• TPSA: 219.63 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 1
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	992.38
LogP ≤ 5	11.86
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)?

The IUPAC name of 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine) (CID 158371335) is 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine).

What is the SMILES notation for 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)?

The canonical SMILES for 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine) is C.CCc1nnc(C)s1.Cc1cc(C)nc(C)n1.Cc1cc(C)nc(C)n1.Cc1cc(C)on1.Cc1ccccn1.Cc1ccnc(C)n1.Cc1ncccn1.Cc1nncs1.Cc1noc(C)c1C.

What is the InChIKey of 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)?

The InChIKey is GUQMZTUWIOYSJU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H10N2.C6H8N2.C6H9NO.C6H7N.C5H8N2S.C5H6N2.C5H7NO.C3H4N2S.CH4/c2*1-5-4-6(2)9-7(3)8-5;1-5-3-4-7-6(2)8-5;1-4-5(2)7-8-6(4)3;1-6-4-2-3-5-7-6;1-3-5-7-6-4(2)8-5;1-5-6-3-2-4-7-5;1-4-3-5(2)7-6-4;1-3-5-4-2-6-3;/h2*4H,1-3H3;3-4H,1-2H3;1-3H3;2-5H,1H3;3H2,1-2H3;2-4H,1H3;3H,1-2H3;2H,1H3;1H4.

What are the key properties of 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine)?

3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine) has a molecular weight of 992.38 g/mol, XLogP of 11.86, 1 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 3,5-dimethyl-1,2-oxazole;2,4-dimethylpyrimidine;2-ethyl-5-methyl-1,3,4-thiadiazole;methane;2-methylpyridine;2-methylpyrimidine;2-methyl-1,3,4-thiadiazole;3,4,5-trimethyl-1,2-oxazole;bis(2,4,6-trimethylpyrimidine) is sourced from PubChem (CID 158371335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).