1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole

C148H240F2N28O8S4 — CID 158674485

About 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole

1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole (PubChem CID 158674485) has the molecular formula C148H240F2N28O8S4 and a molecular weight of 2706.00 g/mol. Its IUPAC name is 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole.

Molecular Properties

• Compound Name: 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole
• PubChem CID: 158674485
• Molecular Formula: C148H240F2N28O8S4
• Molecular Weight: 2706.00 g/mol
• Exact Mass: 2703.81
• IUPAC Name: 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole
• SMILES: CC(C)C1=NC(C)(C)CS1.CC(C)c1ccnn1C.CC(C)c1ccon1.CC(C)c1cn(C)nc1F.CC(C)c1cnco1.CC(C)c1cnn(C)c1F.CC(C)c1ncco1.CC(C)c1nccs1.Cc1c(C(C)C)cnn1C1CC1.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)nn1C.Cc1cc(C(C)C)no1.Cc1cn(C)nc1C(C)C.Cc1cnc(C(C)C)s1.Cc1coc(C(C)C)n1.Cc1nc(C(C)C)sc1C.Cc1nc(C)c(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncoc1C(C)C.Cc1nn(C2CC2)cc1C(C)C
• InChI: InChI=1S/2C10H16N2.3C8H14N2.C8H13NO.C8H15NS.C8H13NS.2C7H11FN2.C7H12N2.4C7H11NO.C7H11NS.3C6H9NO.C6H9NS/c1-7(2)10-6-12(9-4-5-9)11-8(10)3;1-7(2)10-6-11-12(8(10)3)9-4-5-9;1-6(2)8-7(3)5-10(4)9-8;1-6(2)8-5-7(3)10(4)9-8;1-6(2)8-5-7(3)9-10(8)4;1-5(2)8-6(3)9-7(4)10-8;1-6(2)7-9-8(3,4)5-10-7;1-5(2)8-9-6(3)7(4)10-8;1-5(2)6-4-10(3)9-7(6)8;1-5(2)6-4-9-10(3)7(6)8;1-6(2)7-4-5-8-9(7)3;1-5(2)7-6(3)8-4-9-7;1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-5(2)7-8-4-6(3)9-7;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-7-3-4-8-6/h2*6-7,9H,4-5H2,1-3H3;3*5-6H,1-4H3;5H,1-4H3;6H,5H2,1-4H3;5H,1-4H3;2*4-5H,1-3H3;4-6H,1-3H3;5*4-5H,1-3H3;4*3-5H,1-2H3
• InChIKey: IEIQCSGAAQYHOG-UHFFFAOYSA-N
• XLogP: 42.29
• TPSA: 401.83 Ų
• H-Bond Acceptors: 40
• Rotatable Bonds: 22
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2706.00
LogP ≤ 5	42.29
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	40

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole?

The IUPAC name of 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole (CID 158674485) is 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole.

What is the SMILES notation for 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole?

The canonical SMILES for 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole is CC(C)C1=NC(C)(C)CS1.CC(C)c1ccnn1C.CC(C)c1ccon1.CC(C)c1cn(C)nc1F.CC(C)c1cnco1.CC(C)c1cnn(C)c1F.CC(C)c1ncco1.CC(C)c1nccs1.Cc1c(C(C)C)cnn1C1CC1.Cc1cc(C(C)C)n(C)n1.Cc1cc(C(C)C)nn1C.Cc1cc(C(C)C)no1.Cc1cn(C)nc1C(C)C.Cc1cnc(C(C)C)s1.Cc1coc(C(C)C)n1.Cc1nc(C(C)C)sc1C.Cc1nc(C)c(C(C)C)o1.Cc1ncc(C(C)C)o1.Cc1ncoc1C(C)C.Cc1nn(C2CC2)cc1C(C)C.

What is the InChIKey of 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole?

The InChIKey is IEIQCSGAAQYHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H16N2.3C8H14N2.C8H13NO.C8H15NS.C8H13NS.2C7H11FN2.C7H12N2.4C7H11NO.C7H11NS.3C6H9NO.C6H9NS/c1-7(2)10-6-12(9-4-5-9)11-8(10)3;1-7(2)10-6-11-12(8(10)3)9-4-5-9;1-6(2)8-7(3)5-10(4)9-8;1-6(2)8-5-7(3)10(4)9-8;1-6(2)8-5-7(3)9-10(8)4;1-5(2)8-6(3)9-7(4)10-8;1-6(2)7-9-8(3,4)5-10-7;1-5(2)8-9-6(3)7(4)10-8;1-5(2)6-4-10(3)9-7(6)8;1-5(2)6-4-9-10(3)7(6)8;1-6(2)7-4-5-8-9(7)3;1-5(2)7-6(3)8-4-9-7;1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-5(2)7-8-4-6(3)9-7;1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-7-3-4-8-6/h2*6-7,9H,4-5H2,1-3H3;3*5-6H,1-4H3;5H,1-4H3;6H,5H2,1-4H3;5H,1-4H3;2*4-5H,1-3H3;4-6H,1-3H3;5*4-5H,1-3H3;4*3-5H,1-2H3.

What are the key properties of 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole?

1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole has a molecular weight of 2706.00 g/mol, XLogP of 42.29, 22 rotatable bonds, 0 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropyl-3-methyl-4-propan-2-ylpyrazole;1-cyclopropyl-5-methyl-4-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;1,4-dimethyl-3-propan-2-ylpyrazole;1,5-dimethyl-3-propan-2-ylpyrazole;4,4-dimethyl-2-propan-2-yl-5H-1,3-thiazole;4,5-dimethyl-2-propan-2-yl-1,3-thiazole;3-fluoro-1-methyl-4-propan-2-ylpyrazole;5-fluoro-1-methyl-4-propan-2-ylpyrazole;2-methyl-5-propan-2-yl-1,3-oxazole;4-methyl-2-propan-2-yl-1,3-oxazole;4-methyl-5-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;1-methyl-5-propan-2-ylpyrazole;5-methyl-2-propan-2-yl-1,3-thiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 158674485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).