N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide

C22H23ClF3N5O — CID 76903148

About N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide

N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide (PubChem CID 76903148) has the molecular formula C22H23ClF3N5O and a molecular weight of 465.91 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

• Compound Name: N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide
• PubChem CID: 76903148
• Molecular Formula: C22H23ClF3N5O
• Molecular Weight: 465.91 g/mol
• Exact Mass: 465.15
• IUPAC Name: N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide
• SMILES: Cc1nc(C(F)(F)F)c2n1C(C(=O)Nc1cnn(-c3ccc(Cl)cc3)c1C(C)C)CCC2
• InChI: InChI=1S/C22H23ClF3N5O/c1-12(2)19-16(11-27-31(19)15-9-7-14(23)8-10-15)29-21(32)18-6-4-5-17-20(22(24,25)26)28-13(3)30(17)18/h7-12,18H,4-6H2,1-3H3,(H,29,32)
• InChIKey: OWFMRFUWSPCXDK-UHFFFAOYSA-N
• XLogP: 5.69
• TPSA: 64.74 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	465.91
LogP ≤ 5	5.69
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide (CID 76903148) is N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide.

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

The canonical SMILES for N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide is Cc1nc(C(F)(F)F)c2n1C(C(=O)Nc1cnn(-c3ccc(Cl)cc3)c1C(C)C)CCC2.

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

The InChIKey is OWFMRFUWSPCXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23ClF3N5O/c1-12(2)19-16(11-27-31(19)15-9-7-14(23)8-10-15)29-21(32)18-6-4-5-17-20(22(24,25)26)28-13(3)30(17)18/h7-12,18H,4-6H2,1-3H3,(H,29,32).

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

N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide has a molecular weight of 465.91 g/mol, XLogP of 5.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-yl]-3-methyl-1-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 76903148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).