3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile

C182H210F6N18O14 — CID 159142286

About 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile

3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile (PubChem CID 159142286) has the molecular formula C182H210F6N18O14 and a molecular weight of 2987.78 g/mol. Its IUPAC name is 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile.

Molecular Properties

• Compound Name: 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile
• PubChem CID: 159142286
• Molecular Formula: C182H210F6N18O14
• Molecular Weight: 2987.78 g/mol
• Exact Mass: 2985.62
• IUPAC Name: 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile
• SMILES: CC(C)c1cc(-c2cccc(C#N)c2)on1.CC(C)c1cc(-c2cccc(C(C)(F)F)c2)no1.CC(C)c1cc(-c2cccc(C(C)(F)F)c2)on1.CC(C)c1cc(-c2cccc(OC(C)(F)F)c2)no1.CC(C)c1cc(-c2ccccc2)nn1C.CC(C)c1cc(-c2ccccc2)on1.CC(C)c1cc(C2CCCCC2)nn1C.CC(C)c1nc(-c2ccccc2)no1.COc1cccc(-c2cc(C(C)C)on2)c1.Cc1ccc(-c2cc(C(C)C)on2)cc1.Cc1cccc(-c2cc(C(C)C)no2)c1.Cc1cccc(-c2cc(C(C)C)on2)c1.Cc1cccc(-c2cc(C(C)C)on2)c1.Cc1cccc(-c2coc(C(C)C)n2)c1
• InChI: InChI=1S/C14H15F2NO2.2C14H15F2NO.C13H12N2O.C13H22N2.C13H16N2.C13H15NO2.5C13H15NO.C12H13NO.C11H12N2O/c1-9(2)13-8-12(17-19-13)10-5-4-6-11(7-10)18-14(3,15)16;1-9(2)13-8-12(17-18-13)10-5-4-6-11(7-10)14(3,15)16;1-9(2)12-8-13(18-17-12)10-5-4-6-11(7-10)14(3,15)16;1-9(2)12-7-13(16-15-12)11-5-3-4-10(6-11)8-14;2*1-10(2)13-9-12(14-15(13)3)11-7-5-4-6-8-11;1-9(2)13-8-12(14-16-13)10-5-4-6-11(7-10)15-3;1-9(2)13-8-12(14-15-13)11-6-4-10(3)5-7-11;1-9(2)13-14-12(8-15-13)11-6-4-5-10(3)7-11;2*1-9(2)13-8-12(14-15-13)11-6-4-5-10(3)7-11;1-9(2)12-8-13(15-14-12)11-6-4-5-10(3)7-11;1-9(2)11-8-12(14-13-11)10-6-4-3-5-7-10;1-8(2)11-12-10(13-14-11)9-6-4-3-5-7-9/h4-9H,1-3H3;2*4-9H,1-3H3;3-7,9H,1-2H3;9-11H,4-8H2,1-3H3;4-10H,1-3H3;4-9H,1-3H3;5*4-9H,1-3H3;3-9H,1-2H3;3-8H,1-2H3
• InChIKey: KIFVIFRYYJBGOQ-UHFFFAOYSA-N
• XLogP: 52.41
• TPSA: 403.14 Ų
• H-Bond Acceptors: 32
• Rotatable Bonds: 33
• Heavy Atoms: 220
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2987.78
LogP ≤ 5	52.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile?

The IUPAC name of 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile (CID 159142286) is 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile.

What is the SMILES notation for 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile?

The canonical SMILES for 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile is CC(C)c1cc(-c2cccc(C#N)c2)on1.CC(C)c1cc(-c2cccc(C(C)(F)F)c2)no1.CC(C)c1cc(-c2cccc(C(C)(F)F)c2)on1.CC(C)c1cc(-c2cccc(OC(C)(F)F)c2)no1.CC(C)c1cc(-c2ccccc2)nn1C.CC(C)c1cc(-c2ccccc2)on1.CC(C)c1cc(C2CCCCC2)nn1C.CC(C)c1nc(-c2ccccc2)no1.COc1cccc(-c2cc(C(C)C)on2)c1.Cc1ccc(-c2cc(C(C)C)on2)cc1.Cc1cccc(-c2cc(C(C)C)no2)c1.Cc1cccc(-c2cc(C(C)C)on2)c1.Cc1cccc(-c2cc(C(C)C)on2)c1.Cc1cccc(-c2coc(C(C)C)n2)c1.

What is the InChIKey of 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile?

The InChIKey is KIFVIFRYYJBGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2NO2.2C14H15F2NO.C13H12N2O.C13H22N2.C13H16N2.C13H15NO2.5C13H15NO.C12H13NO.C11H12N2O/c1-9(2)13-8-12(17-19-13)10-5-4-6-11(7-10)18-14(3,15)16;1-9(2)13-8-12(17-18-13)10-5-4-6-11(7-10)14(3,15)16;1-9(2)12-8-13(18-17-12)10-5-4-6-11(7-10)14(3,15)16;1-9(2)12-7-13(16-15-12)11-5-3-4-10(6-11)8-14;2*1-10(2)13-9-12(14-15(13)3)11-7-5-4-6-8-11;1-9(2)13-8-12(14-16-13)10-5-4-6-11(7-10)15-3;1-9(2)13-8-12(14-15-13)11-6-4-10(3)5-7-11;1-9(2)13-14-12(8-15-13)11-6-4-5-10(3)7-11;2*1-9(2)13-8-12(14-15-13)11-6-4-5-10(3)7-11;1-9(2)12-8-13(15-14-12)11-6-4-5-10(3)7-11;1-9(2)11-8-12(14-13-11)10-6-4-3-5-7-10;1-8(2)11-12-10(13-14-11)9-6-4-3-5-7-9/h4-9H,1-3H3;2*4-9H,1-3H3;3-7,9H,1-2H3;9-11H,4-8H2,1-3H3;4-10H,1-3H3;4-9H,1-3H3;5*4-9H,1-3H3;3-9H,1-2H3;3-8H,1-2H3.

What are the key properties of 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile?

3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile has a molecular weight of 2987.78 g/mol, XLogP of 52.41, 33 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 3-cyclohexyl-1-methyl-5-propan-2-ylpyrazole;3-[3-(1,1-difluoroethoxy)phenyl]-5-propan-2-yl-1,2-oxazole;3-[3-(1,1-difluoroethyl)phenyl]-5-propan-2-yl-1,2-oxazole;5-[3-(1,1-difluoroethyl)phenyl]-3-propan-2-yl-1,2-oxazole;3-(3-methoxyphenyl)-5-propan-2-yl-1,2-oxazole;bis(3-(3-methylphenyl)-5-propan-2-yl-1,2-oxazole);3-(4-methylphenyl)-5-propan-2-yl-1,2-oxazole;4-(3-methylphenyl)-2-propan-2-yl-1,3-oxazole;5-(3-methylphenyl)-3-propan-2-yl-1,2-oxazole;1-methyl-3-phenyl-5-propan-2-ylpyrazole;3-phenyl-5-propan-2-yl-1,2,4-oxadiazole;5-phenyl-3-propan-2-yl-1,2-oxazole;3-(3-propan-2-yl-1,2-oxazol-5-yl)benzonitrile is sourced from PubChem (CID 159142286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).