5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole

C132H202N22O12S — CID 159346795

About 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole

5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole (PubChem CID 159346795) has the molecular formula C132H202N22O12S and a molecular weight of 2321.28 g/mol. Its IUPAC name is 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole.

Molecular Properties

• Compound Name: 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole
• PubChem CID: 159346795
• Molecular Formula: C132H202N22O12S
• Molecular Weight: 2321.28 g/mol
• Exact Mass: 2319.56
• IUPAC Name: 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole
• SMILES: CC(C)(C)Cc1cc(-c2ccccn2)on1.CC(C)(C)Cc1coc(C2CC2)n1.CC(C)(C)Cc1coc(C2CCC2)n1.CC(C)(C)Cc1ncc(C(C)(C)C)o1.CC(C)(C)Cc1nnc(C2CC2)o1.CC(C)(C)Cc1nnc(C2CC2)s1.CC(C)(C)Cc1noc(-c2ccccn2)n1.CC(c1nc(-c2ncccn2)no1)C(C)(C)C.CC(c1nc(C2CC2)no1)C(C)(C)C.COc1cc(OC)nc(CC(C)(C)C)n1.Cc1coc(CC(C)(C)C)n1.Cc1conc1CC(C)(C)C
• InChI: InChI=1S/C13H16N2O.C12H16N4O.C12H15N3O.C12H19NO.C12H21NO.C11H18N2O2.C11H18N2O.C11H17NO.C10H16N2O.C10H16N2S.2C9H15NO/c1-13(2,3)9-10-8-12(16-15-10)11-6-4-5-7-14-11;1-8(12(2,3)4)11-15-10(16-17-11)9-13-6-5-7-14-9;1-12(2,3)8-10-14-11(16-15-10)9-6-4-5-7-13-9;1-12(2,3)7-10-8-14-11(13-10)9-5-4-6-9;1-11(2,3)7-10-13-8-9(14-10)12(4,5)6;1-11(2,3)7-8-12-9(14-4)6-10(13-8)15-5;1-7(11(2,3)4)10-12-9(13-14-10)8-5-6-8;1-11(2,3)6-9-7-13-10(12-9)8-4-5-8;2*1-10(2,3)6-8-11-12-9(13-8)7-4-5-7;1-7-6-11-8(10-7)5-9(2,3)4;1-7-6-11-10-8(7)5-9(2,3)4/h4-8H,9H2,1-3H3;5-8H,1-4H3;4-7H,8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,7H2,1-6H3;6H,7H2,1-5H3;7-8H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;2*7H,4-6H2,1-3H3;2*6H,5H2,1-4H3
• InChIKey: LGVCCZHFWDBLTL-UHFFFAOYSA-N
• XLogP: 34.82
• TPSA: 433.44 Ų
• H-Bond Acceptors: 35
• Rotatable Bonds: 22
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2321.28
LogP ≤ 5	34.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole?

The IUPAC name of 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole (CID 159346795) is 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole.

What is the SMILES notation for 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole?

The canonical SMILES for 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole is CC(C)(C)Cc1cc(-c2ccccn2)on1.CC(C)(C)Cc1coc(C2CC2)n1.CC(C)(C)Cc1coc(C2CCC2)n1.CC(C)(C)Cc1ncc(C(C)(C)C)o1.CC(C)(C)Cc1nnc(C2CC2)o1.CC(C)(C)Cc1nnc(C2CC2)s1.CC(C)(C)Cc1noc(-c2ccccn2)n1.CC(c1nc(-c2ncccn2)no1)C(C)(C)C.CC(c1nc(C2CC2)no1)C(C)(C)C.COc1cc(OC)nc(CC(C)(C)C)n1.Cc1coc(CC(C)(C)C)n1.Cc1conc1CC(C)(C)C.

What is the InChIKey of 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole?

The InChIKey is LGVCCZHFWDBLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O.C12H16N4O.C12H15N3O.C12H19NO.C12H21NO.C11H18N2O2.C11H18N2O.C11H17NO.C10H16N2O.C10H16N2S.2C9H15NO/c1-13(2,3)9-10-8-12(16-15-10)11-6-4-5-7-14-11;1-8(12(2,3)4)11-15-10(16-17-11)9-13-6-5-7-14-9;1-12(2,3)8-10-14-11(16-15-10)9-6-4-5-7-13-9;1-12(2,3)7-10-8-14-11(13-10)9-5-4-6-9;1-11(2,3)7-10-13-8-9(14-10)12(4,5)6;1-11(2,3)7-8-12-9(14-4)6-10(13-8)15-5;1-7(11(2,3)4)10-12-9(13-14-10)8-5-6-8;1-11(2,3)6-9-7-13-10(12-9)8-4-5-8;2*1-10(2,3)6-8-11-12-9(13-8)7-4-5-7;1-7-6-11-8(10-7)5-9(2,3)4;1-7-6-11-10-8(7)5-9(2,3)4/h4-8H,9H2,1-3H3;5-8H,1-4H3;4-7H,8H2,1-3H3;8-9H,4-7H2,1-3H3;8H,7H2,1-6H3;6H,7H2,1-5H3;7-8H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;2*7H,4-6H2,1-3H3;2*6H,5H2,1-4H3.

What are the key properties of 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole?

5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole has a molecular weight of 2321.28 g/mol, XLogP of 34.82, 22 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-2-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclobutyl-4-(2,2-dimethylpropyl)-1,3-oxazole;3-cyclopropyl-5-(3,3-dimethylbutan-2-yl)-1,2,4-oxadiazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-oxadiazole;2-cyclopropyl-4-(2,2-dimethylpropyl)-1,3-oxazole;2-cyclopropyl-5-(2,2-dimethylpropyl)-1,3,4-thiadiazole;5-(3,3-dimethylbutan-2-yl)-3-pyrimidin-2-yl-1,2,4-oxadiazole;2-(2,2-dimethylpropyl)-4,6-dimethoxypyrimidine;2-(2,2-dimethylpropyl)-4-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-4-methyl-1,2-oxazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2,4-oxadiazole;3-(2,2-dimethylpropyl)-5-pyridin-2-yl-1,2-oxazole is sourced from PubChem (CID 159346795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).