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

C21H21N7O2 — CID 170332218

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

(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (PubChem CID 170332218) has the molecular formula C21H21N7O2 and a molecular weight of 403.45 g/mol. Its IUPAC name is (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.

Molecular Properties

• Compound Name: (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
• PubChem CID: 170332218
• Molecular Formula: C21H21N7O2
• Molecular Weight: 403.45 g/mol
• Exact Mass: 403.18
• IUPAC Name: (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
• SMILES: Cc1cccn2nc([C@H]3c4nc[nH]c4CCN3C(=O)c3nnc(C4CCC4)o3)cc12
• InChI: InChI=1S/C21H21N7O2/c1-12-4-3-8-28-16(12)10-15(26-28)18-17-14(22-11-23-17)7-9-27(18)21(29)20-25-24-19(30-20)13-5-2-6-13/h3-4,8,10-11,13,18H,2,5-7,9H2,1H3,(H,22,23)/t18-/m0/s1
• InChIKey: QWAICZYOIRQDJQ-SFHVURJKSA-N
• XLogP: 2.80
• TPSA: 105.21 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	403.45
LogP ≤ 5	2.80
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (CID 170332218) is (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.

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

The canonical SMILES for (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is Cc1cccn2nc([C@H]3c4nc[nH]c4CCN3C(=O)c3nnc(C4CCC4)o3)cc12.

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

The InChIKey is QWAICZYOIRQDJQ-SFHVURJKSA-N. The full InChI is InChI=1S/C21H21N7O2/c1-12-4-3-8-28-16(12)10-15(26-28)18-17-14(22-11-23-17)7-9-27(18)21(29)20-25-24-19(30-20)13-5-2-6-13/h3-4,8,10-11,13,18H,2,5-7,9H2,1H3,(H,22,23)/t18-/m0/s1.

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

(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone has a molecular weight of 403.45 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (5-cyclobutyl-1,3,4-oxadiazol-2-yl)-[(4R)-4-(4-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is sourced from PubChem (CID 170332218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).