2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone

C46H46Cl2F6N8O2 — CID 158982900

About 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone

2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone (PubChem CID 158982900) has the molecular formula C46H46Cl2F6N8O2 and a molecular weight of 927.82 g/mol. Its IUPAC name is 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone.

Molecular Properties

• Compound Name: 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone
• PubChem CID: 158982900
• Molecular Formula: C46H46Cl2F6N8O2
• Molecular Weight: 927.82 g/mol
• Exact Mass: 926.30
• IUPAC Name: 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone
• SMILES: Cc1nc(C(F)(F)F)c2n1C(C(=O)Cc1cnn(-c3ccc(Cl)cc3)c1C(C)C)CC=C2.Cc1nc(C(F)(F)F)c2n1C(C(=O)Cc1cnn(-c3ccc(Cl)cc3)c1C(C)C)CCC2
• InChI: InChI=1S/C23H24ClF3N4O.C23H22ClF3N4O/c2*1-13(2)21-15(12-28-31(21)17-9-7-16(24)8-10-17)11-20(32)18-5-4-6-19-22(23(25,26)27)29-14(3)30(18)19/h7-10,12-13,18H,4-6,11H2,1-3H3;4,6-10,12-13,18H,5,11H2,1-3H3
• InChIKey: JPFKYOPLRIALOU-UHFFFAOYSA-N
• XLogP: 11.80
• TPSA: 105.42 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 10
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	927.82
LogP ≤ 5	11.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone?

The IUPAC name of 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone (CID 158982900) is 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone.

What is the SMILES notation for 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone?

The canonical SMILES for 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone is Cc1nc(C(F)(F)F)c2n1C(C(=O)Cc1cnn(-c3ccc(Cl)cc3)c1C(C)C)CC=C2.Cc1nc(C(F)(F)F)c2n1C(C(=O)Cc1cnn(-c3ccc(Cl)cc3)c1C(C)C)CCC2.

What is the InChIKey of 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone?

The InChIKey is JPFKYOPLRIALOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClF3N4O.C23H22ClF3N4O/c2*1-13(2)21-15(12-28-31(21)17-9-7-16(24)8-10-17)11-20(32)18-5-4-6-19-22(23(25,26)27)29-14(3)30(18)19/h7-10,12-13,18H,4-6,11H2,1-3H3;4,6-10,12-13,18H,5,11H2,1-3H3.

What are the key properties of 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone?

2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone has a molecular weight of 927.82 g/mol, XLogP of 11.80, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6-dihydroimidazo[1,5-a]pyridin-5-yl]ethanone;2-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-1-[3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-yl]ethanone is sourced from PubChem (CID 158982900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).