2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole

C67H98F6N10O8S2 — CID 159438867

About 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole

2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole (PubChem CID 159438867) has the molecular formula C67H98F6N10O8S2 and a molecular weight of 1349.70 g/mol. Its IUPAC name is 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole.

Molecular Properties

• Compound Name: 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole
• PubChem CID: 159438867
• Molecular Formula: C67H98F6N10O8S2
• Molecular Weight: 1349.70 g/mol
• Exact Mass: 1348.69
• IUPAC Name: 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole
• SMILES: CC(C)c1ccon1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1coc(C(F)(F)F)n1.CC(C)c1cocn1.CC(C)c1ncoc1C(F)(F)F.Cc1nc(C(C)C)co1.Cc1nc(C)c(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncc(C(C)C)s1
• InChI: InChI=1S/C8H13NO.2C7H8F3NO.2C7H11NO.C7H11NS.3C6H9NO.C6H9NS/c1-5(2)8-6(3)9-7(4)10-8;1-4(2)5-6(7(8,9)10)12-3-11-5;1-4(2)5-3-12-6(11-5)7(8,9)10;1-5(2)7-4-9-6(3)8-7;2*1-5(2)7-4-8-6(3)9-7;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-7-4-8-6/h5H,1-4H3;2*3-4H,1-2H3;3*4-5H,1-3H3;4*3-5H,1-2H3
• InChIKey: LRXPHNMQZLMBBC-UHFFFAOYSA-N
• XLogP: 22.50
• TPSA: 234.02 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 10
• Heavy Atoms: 93
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1349.70
LogP ≤ 5	22.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole?

The IUPAC name of 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole (CID 159438867) is 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole.

What is the SMILES notation for 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole?

The canonical SMILES for 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole is CC(C)c1ccon1.CC(C)c1cnco1.CC(C)c1cncs1.CC(C)c1coc(C(F)(F)F)n1.CC(C)c1cocn1.CC(C)c1ncoc1C(F)(F)F.Cc1nc(C(C)C)co1.Cc1nc(C)c(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncc(C(C)C)s1.

What is the InChIKey of 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole?

The InChIKey is LRXPHNMQZLMBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO.2C7H8F3NO.2C7H11NO.C7H11NS.3C6H9NO.C6H9NS/c1-5(2)8-6(3)9-7(4)10-8;1-4(2)5-6(7(8,9)10)12-3-11-5;1-4(2)5-3-12-6(11-5)7(8,9)10;1-5(2)7-4-9-6(3)8-7;2*1-5(2)7-4-8-6(3)9-7;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-7-4-8-6/h5H,1-4H3;2*3-4H,1-2H3;3*4-5H,1-3H3;4*3-5H,1-2H3.

What are the key properties of 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole?

2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole has a molecular weight of 1349.70 g/mol, XLogP of 22.50, 10 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-dimethyl-5-propan-2-yl-1,3-oxazole;2-methyl-4-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-oxazole;2-methyl-5-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-oxazole;5-propan-2-yl-1,3-thiazole;4-propan-2-yl-2-(trifluoromethyl)-1,3-oxazole;4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole is sourced from PubChem (CID 159438867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).