4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole

C36H63N11O — CID 158199526

About 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole

4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole (PubChem CID 158199526) has the molecular formula C36H63N11O and a molecular weight of 665.98 g/mol. Its IUPAC name is 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole.

Molecular Properties

• Compound Name: 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole
• PubChem CID: 158199526
• Molecular Formula: C36H63N11O
• Molecular Weight: 665.98 g/mol
• Exact Mass: 665.52
• IUPAC Name: 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole
• SMILES: CC(C)C1=NC(C)(C)C(C)(C)N1.CC(C)c1cccnc1.CC(C)c1nn[nH]n1.Cc1nc(C(C)C)[nH]c1C.Cc1nnc(C(C)C)o1
• InChI: InChI=1S/C10H20N2.C8H14N2.C8H11N.C6H10N2O.C4H8N4/c1-7(2)8-11-9(3,4)10(5,6)12-8;1-5(2)8-9-6(3)7(4)10-8;1-7(2)8-4-3-5-9-6-8;1-4(2)6-8-7-5(3)9-6;1-3(2)4-5-7-8-6-4/h7H,1-6H3,(H,11,12);5H,1-4H3,(H,9,10);3-7H,1-2H3;4H,1-3H3;3H,1-2H3,(H,5,6,7,8)
• InChIKey: GATKAEBJBUMXBV-UHFFFAOYSA-N
• XLogP: 8.38
• TPSA: 159.34 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 10
• Rotatable Bonds: 5
• Heavy Atoms: 48
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	665.98
LogP ≤ 5	8.38
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole?

The IUPAC name of 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole (CID 158199526) is 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole.

What is the SMILES notation for 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole?

The canonical SMILES for 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole is CC(C)C1=NC(C)(C)C(C)(C)N1.CC(C)c1cccnc1.CC(C)c1nn[nH]n1.Cc1nc(C(C)C)[nH]c1C.Cc1nnc(C(C)C)o1.

What is the InChIKey of 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole?

The InChIKey is GATKAEBJBUMXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2.C8H14N2.C8H11N.C6H10N2O.C4H8N4/c1-7(2)8-11-9(3,4)10(5,6)12-8;1-5(2)8-9-6(3)7(4)10-8;1-7(2)8-4-3-5-9-6-8;1-4(2)6-8-7-5(3)9-6;1-3(2)4-5-7-8-6-4/h7H,1-6H3,(H,11,12);5H,1-4H3,(H,9,10);3-7H,1-2H3;4H,1-3H3;3H,1-2H3,(H,5,6,7,8).

What are the key properties of 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole?

4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole has a molecular weight of 665.98 g/mol, XLogP of 8.38, 5 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 4,5-dimethyl-2-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-propan-2-ylpyridine;5-propan-2-yl-2H-tetrazole;4,4,5,5-tetramethyl-2-propan-2-yl-1H-imidazole is sourced from PubChem (CID 158199526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).