5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole

C144H236F5N33O7S — CID 160817487

About 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole

5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole (PubChem CID 160817487) has the molecular formula C144H236F5N33O7S and a molecular weight of 2668.75 g/mol. Its IUPAC name is 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole.

Molecular Properties

• Compound Name: 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole
• PubChem CID: 160817487
• Molecular Formula: C144H236F5N33O7S
• Molecular Weight: 2668.75 g/mol
• Exact Mass: 2666.88
• IUPAC Name: 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole
• SMILES: CC(C)(C)c1cc(C2CC2)no1.CC(C)(C)c1cnn(Cc2ccccn2)c1.CC(C)c1cc(CC(C)(F)F)no1.CC(C)c1cn(C)cn1.CC(F)(F)Cc1noc(C(C)(C)C)n1.CC(F)c1noc(C(C)(C)C)n1.CCc1cc(C(C)(C)C)on1.CCn1cc(C(C)(C)C)nn1.CCn1ncc(C(C)(C)C)n1.Cc1c(C(C)(C)C)cnn1C.Cc1cc(C(C)(C)C)ccn1.Cc1cc(C(C)C)sn1.Cc1cc(C)n(C(C)C)n1.Cc1coc(C(C)(C)C)n1.Cc1ncn(C(C)(C)C)n1.Cc1nnc(C(C)(C)C)o1.Cn1ncc(C(C)(C)C)n1
• InChI: InChI=1S/C13H17N3.C10H15NO.C10H15N.C9H14F2N2O.C9H13F2NO.C9H16N2.C9H15NO.C8H13FN2O.2C8H15N3.C8H14N2.C8H13NO.2C7H13N3.C7H12N2O.C7H12N2.C7H11NS/c1-13(2,3)11-8-15-16(9-11)10-12-6-4-5-7-14-12;1-10(2,3)9-6-8(11-12-9)7-4-5-7;1-8-7-9(5-6-11-8)10(2,3)4;1-8(2,3)7-12-6(13-14-7)5-9(4,10)11;1-6(2)8-4-7(12-13-8)5-9(3,10)11;1-7-8(9(2,3)4)6-10-11(7)5;1-5-7-6-8(11-10-7)9(2,3)4;1-5(9)6-10-7(12-11-6)8(2,3)4;1-5-11-6-7(9-10-11)8(2,3)4;1-5-11-9-6-7(10-11)8(2,3)4;1-6(2)10-8(4)5-7(3)9-10;1-6-5-10-7(9-6)8(2,3)4;1-7(2,3)6-5-8-10(4)9-6;1-6-8-5-10(9-6)7(2,3)4;1-5-8-9-6(10-5)7(2,3)4;1-6(2)7-4-9(3)5-8-7;1-5(2)7-4-6(3)8-9-7/h4-9H,10H2,1-3H3;6-7H,4-5H2,1-3H3;5-7H,1-4H3;5H2,1-4H3;4,6H,5H2,1-3H3;6H,1-5H3;6H,5H2,1-4H3;5H,1-4H3;2*6H,5H2,1-4H3;5-6H,1-4H3;3*5H,1-4H3;1-4H3;4-6H,1-3H3;4-5H,1-3H3
• InChIKey: SFCBGPIYRPYTNV-UHFFFAOYSA-N
• XLogP: 36.48
• TPSA: 453.67 Ų
• H-Bond Acceptors: 41
• Rotatable Bonds: 15
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2668.75
LogP ≤ 5	36.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole?

The IUPAC name of 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole (CID 160817487) is 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole.

What is the SMILES notation for 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole?

The canonical SMILES for 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole is CC(C)(C)c1cc(C2CC2)no1.CC(C)(C)c1cnn(Cc2ccccn2)c1.CC(C)c1cc(CC(C)(F)F)no1.CC(C)c1cn(C)cn1.CC(F)(F)Cc1noc(C(C)(C)C)n1.CC(F)c1noc(C(C)(C)C)n1.CCc1cc(C(C)(C)C)on1.CCn1cc(C(C)(C)C)nn1.CCn1ncc(C(C)(C)C)n1.Cc1c(C(C)(C)C)cnn1C.Cc1cc(C(C)(C)C)ccn1.Cc1cc(C(C)C)sn1.Cc1cc(C)n(C(C)C)n1.Cc1coc(C(C)(C)C)n1.Cc1ncn(C(C)(C)C)n1.Cc1nnc(C(C)(C)C)o1.Cn1ncc(C(C)(C)C)n1.

What is the InChIKey of 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole?

The InChIKey is SFCBGPIYRPYTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3.C10H15NO.C10H15N.C9H14F2N2O.C9H13F2NO.C9H16N2.C9H15NO.C8H13FN2O.2C8H15N3.C8H14N2.C8H13NO.2C7H13N3.C7H12N2O.C7H12N2.C7H11NS/c1-13(2,3)11-8-15-16(9-11)10-12-6-4-5-7-14-12;1-10(2,3)9-6-8(11-12-9)7-4-5-7;1-8-7-9(5-6-11-8)10(2,3)4;1-8(2,3)7-12-6(13-14-7)5-9(4,10)11;1-6(2)8-4-7(12-13-8)5-9(3,10)11;1-7-8(9(2,3)4)6-10-11(7)5;1-5-7-6-8(11-10-7)9(2,3)4;1-5(9)6-10-7(12-11-6)8(2,3)4;1-5-11-6-7(9-10-11)8(2,3)4;1-5-11-9-6-7(10-11)8(2,3)4;1-6(2)10-8(4)5-7(3)9-10;1-6-5-10-7(9-6)8(2,3)4;1-7(2,3)6-5-8-10(4)9-6;1-6-8-5-10(9-6)7(2,3)4;1-5-8-9-6(10-5)7(2,3)4;1-6(2)7-4-9(3)5-8-7;1-5(2)7-4-6(3)8-9-7/h4-9H,10H2,1-3H3;6-7H,4-5H2,1-3H3;5-7H,1-4H3;5H2,1-4H3;4,6H,5H2,1-3H3;6H,1-5H3;6H,5H2,1-4H3;5H,1-4H3;2*6H,5H2,1-4H3;5-6H,1-4H3;3*5H,1-4H3;1-4H3;4-6H,1-3H3;4-5H,1-3H3.

What are the key properties of 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole?

5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole has a molecular weight of 2668.75 g/mol, XLogP of 36.48, 15 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-3-cyclopropyl-1,2-oxazole;5-tert-butyl-3-(2,2-difluoropropyl)-1,2,4-oxadiazole;4-tert-butyl-1,5-dimethylpyrazole;5-tert-butyl-3-ethyl-1,2-oxazole;4-tert-butyl-1-ethyltriazole;4-tert-butyl-2-ethyltriazole;5-tert-butyl-3-(1-fluoroethyl)-1,2,4-oxadiazole;2-tert-butyl-5-methyl-1,3,4-oxadiazole;2-tert-butyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methylpyridine;1-tert-butyl-3-methyl-1,2,4-triazole;4-tert-butyl-2-methyltriazole;2-[(4-tert-butylpyrazol-1-yl)methyl]pyridine;3-(2,2-difluoropropyl)-5-propan-2-yl-1,2-oxazole;3,5-dimethyl-1-propan-2-ylpyrazole;1-methyl-4-propan-2-ylimidazole;3-methyl-5-propan-2-yl-1,2-thiazole is sourced from PubChem (CID 160817487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).