2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone

C103H108F2N18O8 — CID 159327629

About 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone

2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone (PubChem CID 159327629) has the molecular formula C103H108F2N18O8 and a molecular weight of 1764.11 g/mol. Its IUPAC name is 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone.

Molecular Properties

• Compound Name: 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone
• PubChem CID: 159327629
• Molecular Formula: C103H108F2N18O8
• Molecular Weight: 1764.11 g/mol
• Exact Mass: 1762.86
• IUPAC Name: 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone
• SMILES: CCCc1cc(-c2ccc(F)c(C)c2)nn1CC(=O)N1CC=C(c2ncc(C)o2)CC1.CCc1cc(-c2ccc(F)c(C)c2)nn1CC(=O)N1CC=C(c2ncc(C)o2)CC1.COc1cnc(C2=CCN(C(=O)Cn3nc(-c4cccc(C)c4)cc3-c3ccccc3)CC2)nc1.COc1cnc(C2CCN(C(=O)Cn3nc(-c4cccc(C)c4)cc3-c3ccccc3)CC2)nc1
• InChI: InChI=1S/C28H29N5O2.C28H27N5O2.C24H27FN4O2.C23H25FN4O2/c2*1-20-7-6-10-23(15-20)25-16-26(21-8-4-3-5-9-21)33(31-25)19-27(34)32-13-11-22(12-14-32)28-29-17-24(35-2)18-30-28;1-4-5-20-13-22(19-6-7-21(25)16(2)12-19)27-29(20)15-23(30)28-10-8-18(9-11-28)24-26-14-17(3)31-24;1-4-19-12-21(18-5-6-20(24)15(2)11-18)26-28(19)14-22(29)27-9-7-17(8-10-27)23-25-13-16(3)30-23/h3-10,15-18,22H,11-14,19H2,1-2H3;3-11,15-18H,12-14,19H2,1-2H3;6-8,12-14H,4-5,9-11,15H2,1-3H3;5-7,11-13H,4,8-10,14H2,1-3H3
• InChIKey: LEOIAEDHOBYXGF-UHFFFAOYSA-N
• XLogP: 18.11
• TPSA: 274.60 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 23
• Heavy Atoms: 131
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1764.11
LogP ≤ 5	18.11
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone?

The IUPAC name of 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone (CID 159327629) is 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone.

What is the SMILES notation for 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone?

The canonical SMILES for 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone is CCCc1cc(-c2ccc(F)c(C)c2)nn1CC(=O)N1CC=C(c2ncc(C)o2)CC1.CCc1cc(-c2ccc(F)c(C)c2)nn1CC(=O)N1CC=C(c2ncc(C)o2)CC1.COc1cnc(C2=CCN(C(=O)Cn3nc(-c4cccc(C)c4)cc3-c3ccccc3)CC2)nc1.COc1cnc(C2CCN(C(=O)Cn3nc(-c4cccc(C)c4)cc3-c3ccccc3)CC2)nc1.

What is the InChIKey of 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone?

The InChIKey is LEOIAEDHOBYXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N5O2.C28H27N5O2.C24H27FN4O2.C23H25FN4O2/c2*1-20-7-6-10-23(15-20)25-16-26(21-8-4-3-5-9-21)33(31-25)19-27(34)32-13-11-22(12-14-32)28-29-17-24(35-2)18-30-28;1-4-5-20-13-22(19-6-7-21(25)16(2)12-19)27-29(20)15-23(30)28-10-8-18(9-11-28)24-26-14-17(3)31-24;1-4-19-12-21(18-5-6-20(24)15(2)11-18)26-28(19)14-22(29)27-9-7-17(8-10-27)23-25-13-16(3)30-23/h3-10,15-18,22H,11-14,19H2,1-2H3;3-11,15-18H,12-14,19H2,1-2H3;6-8,12-14H,4-5,9-11,15H2,1-3H3;5-7,11-13H,4,8-10,14H2,1-3H3.

What are the key properties of 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone?

2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone has a molecular weight of 1764.11 g/mol, XLogP of 18.11, 23 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-ethyl-3-(4-fluoro-3-methylphenyl)pyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;2-[3-(4-fluoro-3-methylphenyl)-5-propylpyrazol-1-yl]-1-[4-(5-methyl-1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)-3,6-dihydro-2H-pyridin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone;1-[4-(5-methoxypyrimidin-2-yl)piperidin-1-yl]-2-[3-(3-methylphenyl)-5-phenylpyrazol-1-yl]ethanone is sourced from PubChem (CID 159327629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).