2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole

C22H17F3N8O — CID 169165200

About 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole

2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole (PubChem CID 169165200) has the molecular formula C22H17F3N8O and a molecular weight of 466.43 g/mol. Its IUPAC name is 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole.

Molecular Properties

• Compound Name: 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole
• PubChem CID: 169165200
• Molecular Formula: C22H17F3N8O
• Molecular Weight: 466.43 g/mol
• Exact Mass: 466.15
• IUPAC Name: 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole
• SMILES: Cc1cccnc1-c1nnc(N2CCc3[nH]cnc3[C@@H]2c2cc3cccc(C(F)(F)F)n3n2)o1
• InChI: InChI=1S/C22H17F3N8O/c1-12-4-3-8-26-17(12)20-29-30-21(34-20)32-9-7-14-18(28-11-27-14)19(32)15-10-13-5-2-6-16(22(23,24)25)33(13)31-15/h2-6,8,10-11,19H,7,9H2,1H3,(H,27,28)/t19-/m0/s1
• InChIKey: JXJBBTUCPURJTK-IBGZPJMESA-N
• XLogP: 3.98
• TPSA: 101.03 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 3
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	466.43
LogP ≤ 5	3.98
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole?

The IUPAC name of 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole (CID 169165200) is 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole.

What is the SMILES notation for 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole?

The canonical SMILES for 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole is Cc1cccnc1-c1nnc(N2CCc3[nH]cnc3[C@@H]2c2cc3cccc(C(F)(F)F)n3n2)o1.

What is the InChIKey of 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole?

The InChIKey is JXJBBTUCPURJTK-IBGZPJMESA-N. The full InChI is InChI=1S/C22H17F3N8O/c1-12-4-3-8-26-17(12)20-29-30-21(34-20)32-9-7-14-18(28-11-27-14)19(32)15-10-13-5-2-6-16(22(23,24)25)33(13)31-15/h2-6,8,10-11,19H,7,9H2,1H3,(H,27,28)/t19-/m0/s1.

What are the key properties of 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole?

2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole has a molecular weight of 466.43 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole is sourced from PubChem (CID 169165200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).