5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine

C138H223N25O6S — CID 159409644

About 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine

5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine (PubChem CID 159409644) has the molecular formula C138H223N25O6S and a molecular weight of 2360.54 g/mol. Its IUPAC name is 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine.

Molecular Properties

• Compound Name: 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine
• PubChem CID: 159409644
• Molecular Formula: C138H223N25O6S
• Molecular Weight: 2360.54 g/mol
• Exact Mass: 2358.76
• IUPAC Name: 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine
• SMILES: CC(C)C1=NN=CC1.CC(C)c1ccccn1.CC(C)c1cccn1C.CC(C)c1ccn(C)n1.CC(C)c1cnc(C(C)C)o1.CC(C)c1ncc(C(C)(C)C)o1.CC(C)c1nccn1C.CC(C)c1ncco1.CCc1cnc(C(C)C)o1.CCn1ccc(C(C)C)n1.CCn1cccc1C(C)C.Cc1cc(C(C)C)n[nH]1.Cc1cccc(C(C)C)n1.Cc1cccnc1C(C)C.Cc1cn[nH]c1C(C)C.Cc1cnc(C(C)C)o1.Cc1cnc(C(C)C)s1.Cc1noc(C(C)C)n1
• InChI: InChI=1S/C10H17NO.C9H15NO.2C9H13N.C9H15N.C8H14N2.C8H13NO.C8H13N.C8H11N.4C7H12N2.C7H11NO.C7H11NS.C6H10N2O.C6H10N2.C6H9NO/c1-7(2)9-11-6-8(12-9)10(3,4)5;1-6(2)8-5-10-9(11-8)7(3)4;1-7(2)9-8(3)5-4-6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-4-10-7-5-6-9(10)8(2)3;1-4-10-6-5-8(9-10)7(2)3;1-4-7-5-9-8(10-7)6(2)3;1-7(2)8-5-4-6-9(8)3;1-7(2)8-5-3-4-6-9-8;1-6(2)7-8-4-5-9(7)3;1-6(2)7-4-5-9(3)8-7;1-5(2)7-6(3)4-8-9-7;1-5(2)7-4-6(3)8-9-7;2*1-5(2)7-8-4-6(3)9-7;1-4(2)6-7-5(3)8-9-6;1-5(2)6-3-4-7-8-6;1-5(2)6-7-3-4-8-6/h6-7H,1-5H3;5-7H,1-4H3;2*4-7H,1-3H3;5-8H,4H2,1-3H3;5-7H,4H2,1-3H3;5-6H,4H2,1-3H3;4-7H,1-3H3;3-7H,1-2H3;2*4-6H,1-3H3;2*4-5H,1-3H3,(H,8,9);2*4-5H,1-3H3;4H,1-3H3;4-5H,3H2,1-2H3;3-5H,1-2H3
• InChIKey: LOKKLSNKRJRVKK-UHFFFAOYSA-N
• XLogP: 38.64
• TPSA: 366.03 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 30
• Rotatable Bonds: 22
• Heavy Atoms: 170
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2360.54
LogP ≤ 5	38.64
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine?

The IUPAC name of 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine (CID 159409644) is 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine.

What is the SMILES notation for 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine?

The canonical SMILES for 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine is CC(C)C1=NN=CC1.CC(C)c1ccccn1.CC(C)c1cccn1C.CC(C)c1ccn(C)n1.CC(C)c1cnc(C(C)C)o1.CC(C)c1ncc(C(C)(C)C)o1.CC(C)c1nccn1C.CC(C)c1ncco1.CCc1cnc(C(C)C)o1.CCn1ccc(C(C)C)n1.CCn1cccc1C(C)C.Cc1cc(C(C)C)n[nH]1.Cc1cccc(C(C)C)n1.Cc1cccnc1C(C)C.Cc1cn[nH]c1C(C)C.Cc1cnc(C(C)C)o1.Cc1cnc(C(C)C)s1.Cc1noc(C(C)C)n1.

What is the InChIKey of 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine?

The InChIKey is LOKKLSNKRJRVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO.C9H15NO.2C9H13N.C9H15N.C8H14N2.C8H13NO.C8H13N.C8H11N.4C7H12N2.C7H11NO.C7H11NS.C6H10N2O.C6H10N2.C6H9NO/c1-7(2)9-11-6-8(12-9)10(3,4)5;1-6(2)8-5-10-9(11-8)7(3)4;1-7(2)9-8(3)5-4-6-10-9;1-7(2)9-6-4-5-8(3)10-9;1-4-10-7-5-6-9(10)8(2)3;1-4-10-6-5-8(9-10)7(2)3;1-4-7-5-9-8(10-7)6(2)3;1-7(2)8-5-4-6-9(8)3;1-7(2)8-5-3-4-6-9-8;1-6(2)7-8-4-5-9(7)3;1-6(2)7-4-5-9(3)8-7;1-5(2)7-6(3)4-8-9-7;1-5(2)7-4-6(3)8-9-7;2*1-5(2)7-8-4-6(3)9-7;1-4(2)6-7-5(3)8-9-6;1-5(2)6-3-4-7-8-6;1-5(2)6-7-3-4-8-6/h6-7H,1-5H3;5-7H,1-4H3;2*4-7H,1-3H3;5-8H,4H2,1-3H3;5-7H,4H2,1-3H3;5-6H,4H2,1-3H3;4-7H,1-3H3;3-7H,1-2H3;2*4-6H,1-3H3;2*4-5H,1-3H3,(H,8,9);2*4-5H,1-3H3;4H,1-3H3;4-5H,3H2,1-2H3;3-5H,1-2H3.

What are the key properties of 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine?

5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine has a molecular weight of 2360.54 g/mol, XLogP of 38.64, 22 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-2-propan-2-yl-1,3-oxazole;2,5-di(propan-2-yl)-1,3-oxazole;5-ethyl-2-propan-2-yl-1,3-oxazole;1-ethyl-3-propan-2-ylpyrazole;1-ethyl-2-propan-2-ylpyrrole;1-methyl-2-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-2-propan-2-yl-1,3-oxazole;1-methyl-3-propan-2-ylpyrazole;4-methyl-5-propan-2-yl-1H-pyrazole;5-methyl-3-propan-2-yl-1H-pyrazole;2-methyl-6-propan-2-ylpyridine;3-methyl-2-propan-2-ylpyridine;1-methyl-2-propan-2-ylpyrrole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-4H-pyrazole;2-propan-2-ylpyridine is sourced from PubChem (CID 159409644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).