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

C23H26N8O2 — CID 176928515

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

[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone (PubChem CID 176928515) has the molecular formula C23H26N8O2 and a molecular weight of 446.52 g/mol. Its IUPAC name is [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone.

Molecular Properties

• Compound Name: [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone
• PubChem CID: 176928515
• Molecular Formula: C23H26N8O2
• Molecular Weight: 446.52 g/mol
• Exact Mass: 446.22
• IUPAC Name: [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone
• SMILES: Cc1cccn2nc([C@H]3c4nc[nH]c4CCN3c3nnc(C(=O)N4[C@H](C)CC[C@@H]4C)o3)cc12
• InChI: InChI=1S/C23H26N8O2/c1-13-5-4-9-30-18(13)11-17(28-30)20-19-16(24-12-25-19)8-10-29(20)23-27-26-21(33-23)22(32)31-14(2)6-7-15(31)3/h4-5,9,11-12,14-15,20H,6-8,10H2,1-3H3,(H,24,25)/t14-,15+,20-/m0/s1
• InChIKey: SZBKLEZHDLHRAQ-MDOVXXIYSA-N
• XLogP: 2.91
• TPSA: 108.45 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 3
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	446.52
LogP ≤ 5	2.91
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

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

The IUPAC name of [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone (CID 176928515) is [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone.

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

The canonical SMILES for [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone is Cc1cccn2nc([C@H]3c4nc[nH]c4CCN3c3nnc(C(=O)N4[C@H](C)CC[C@@H]4C)o3)cc12.

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

The InChIKey is SZBKLEZHDLHRAQ-MDOVXXIYSA-N. The full InChI is InChI=1S/C23H26N8O2/c1-13-5-4-9-30-18(13)11-17(28-30)20-19-16(24-12-25-19)8-10-29(20)23-27-26-21(33-23)22(32)31-14(2)6-7-15(31)3/h4-5,9,11-12,14-15,20H,6-8,10H2,1-3H3,(H,24,25)/t14-,15+,20-/m0/s1.

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

[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone has a molecular weight of 446.52 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R,5S)-2,5-dimethylpyrrolidin-1-yl]-[5-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazol-2-yl]methanone is sourced from PubChem (CID 176928515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).