2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole

C104H155N19O4S4 — CID 158368546

About 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole

2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole (PubChem CID 158368546) has the molecular formula C104H155N19O4S4 and a molecular weight of 1863.78 g/mol. Its IUPAC name is 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole.

Molecular Properties

• Compound Name: 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole
• PubChem CID: 158368546
• Molecular Formula: C104H155N19O4S4
• Molecular Weight: 1863.78 g/mol
• Exact Mass: 1862.14
• IUPAC Name: 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole
• SMILES: CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccs1.CC(C)c1ccncn1.CC(C)c1cnccn1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1ncccn1.CC(C)c1nccnn1.CC(C)c1ncn[nH]1.Cc1cc(C(C)C)on1.Cc1ccc(C(C)C)o1.Cc1ccc(C(C)C)s1.Cc1ncc(C(C)C)o1.Cc1ncc(C(C)C)s1
• InChI: InChI=1S/2C8H11N.C8H12O.C8H12S.3C7H10N2.2C7H11NO.C7H11NS.C7H10S.C6H9N3.C6H9NO.C6H9NS.C5H9N3/c1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;2*1-6(2)8-5-4-7(3)9-8;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;1-5(2)7-4-8-6(3)9-7;1-5(2)7-4-6(3)8-9-7;1-5(2)7-4-8-6(3)9-7;1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-9-6;2*1-5(2)6-3-7-4-8-6;1-4(2)5-6-3-7-8-5/h2*3-7H,1-2H3;2*4-6H,1-3H3;3*3-6H,1-2H3;3*4-5H,1-3H3;3-6H,1-2H3;3-5H,1-2H3;2*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8)
• InChIKey: GUIBYCVUECBDFQ-UHFFFAOYSA-N
• XLogP: 30.75
• TPSA: 300.37 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 15
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1863.78
LogP ≤ 5	30.75
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole?

The IUPAC name of 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole (CID 158368546) is 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole.

What is the SMILES notation for 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole?

The canonical SMILES for 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole is CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccs1.CC(C)c1ccncn1.CC(C)c1cnccn1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1ncccn1.CC(C)c1nccnn1.CC(C)c1ncn[nH]1.Cc1cc(C(C)C)on1.Cc1ccc(C(C)C)o1.Cc1ccc(C(C)C)s1.Cc1ncc(C(C)C)o1.Cc1ncc(C(C)C)s1.

What is the InChIKey of 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole?

The InChIKey is GUIBYCVUECBDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H11N.C8H12O.C8H12S.3C7H10N2.2C7H11NO.C7H11NS.C7H10S.C6H9N3.C6H9NO.C6H9NS.C5H9N3/c1-7(2)8-4-3-5-9-6-8;1-7(2)8-5-3-4-6-9-8;2*1-6(2)8-5-4-7(3)9-8;1-6(2)7-5-8-3-4-9-7;1-6(2)7-3-4-8-5-9-7;1-6(2)7-8-4-3-5-9-7;1-5(2)7-4-8-6(3)9-7;1-5(2)7-4-6(3)8-9-7;1-5(2)7-4-8-6(3)9-7;1-6(2)7-4-3-5-8-7;1-5(2)6-7-3-4-8-9-6;2*1-5(2)6-3-7-4-8-6;1-4(2)5-6-3-7-8-5/h2*3-7H,1-2H3;2*4-6H,1-3H3;3*3-6H,1-2H3;3*4-5H,1-3H3;3-6H,1-2H3;3-5H,1-2H3;2*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8).

What are the key properties of 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole?

2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole has a molecular weight of 1863.78 g/mol, XLogP of 30.75, 15 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-5-propan-2-ylfuran;2-methyl-5-propan-2-yl-1,3-oxazole;3-methyl-5-propan-2-yl-1,2-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;2-methyl-5-propan-2-ylthiophene;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;3-propan-2-yl-1,2,4-triazine;5-propan-2-yl-1H-1,2,4-triazole is sourced from PubChem (CID 158368546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).