(6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone

C23H18F3N7O — CID 169165858

About (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone

(6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (PubChem CID 169165858) has the molecular formula C23H18F3N7O and a molecular weight of 465.44 g/mol. Its IUPAC name is (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.

Molecular Properties

• Compound Name: (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
• PubChem CID: 169165858
• Molecular Formula: C23H18F3N7O
• Molecular Weight: 465.44 g/mol
• Exact Mass: 465.15
• IUPAC Name: (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
• SMILES: Cc1ccc2c(C(=O)N3CCc4[nH]cnc4[C@H]3c3cc4c(C(F)(F)F)cccn4n3)cnn2c1
• InChI: InChI=1S/C23H18F3N7O/c1-13-4-5-18-14(10-29-33(18)11-13)22(34)31-8-6-16-20(28-12-27-16)21(31)17-9-19-15(23(24,25)26)3-2-7-32(19)30-17/h2-5,7,9-12,21H,6,8H2,1H3,(H,27,28)/t21-/m1/s1
• InChIKey: DMYOVLFIROMDHD-OAQYLSRUSA-N
• XLogP: 3.82
• TPSA: 83.59 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 2
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	465.44
LogP ≤ 5	3.82
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?

The IUPAC name of (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (CID 169165858) is (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.

What is the SMILES notation for (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?

The canonical SMILES for (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is Cc1ccc2c(C(=O)N3CCc4[nH]cnc4[C@H]3c3cc4c(C(F)(F)F)cccn4n3)cnn2c1.

What is the InChIKey of (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?

The InChIKey is DMYOVLFIROMDHD-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H18F3N7O/c1-13-4-5-18-14(10-29-33(18)11-13)22(34)31-8-6-16-20(28-12-27-16)21(31)17-9-19-15(23(24,25)26)3-2-7-32(19)30-17/h2-5,7,9-12,21H,6,8H2,1H3,(H,27,28)/t21-/m1/s1.

What are the key properties of (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?

(6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone has a molecular weight of 465.44 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (6-methylpyrazolo[1,5-a]pyridin-3-yl)-[(4S)-4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is sourced from PubChem (CID 169165858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).