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

C20H18ClN7O2 — CID 170332236

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

[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone (PubChem CID 170332236) has the molecular formula C20H18ClN7O2 and a molecular weight of 423.86 g/mol. Its IUPAC name is [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone.

Molecular Properties

• Compound Name: [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone
• PubChem CID: 170332236
• Molecular Formula: C20H18ClN7O2
• Molecular Weight: 423.86 g/mol
• Exact Mass: 423.12
• IUPAC Name: [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone
• SMILES: O=C(c1nnc(C2CCC2)o1)N1CCc2[nH]cnc2C1c1cc2cccc(Cl)n2n1
• InChI: InChI=1S/C20H18ClN7O2/c21-15-6-2-5-12-9-14(26-28(12)15)17-16-13(22-10-23-16)7-8-27(17)20(29)19-25-24-18(30-19)11-3-1-4-11/h2,5-6,9-11,17H,1,3-4,7-8H2,(H,22,23)
• InChIKey: HLCHVKWEAKMCKW-UHFFFAOYSA-N
• XLogP: 3.15
• 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	423.86
LogP ≤ 5	3.15
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

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

The IUPAC name of [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone (CID 170332236) is [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone.

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

The canonical SMILES for [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone is O=C(c1nnc(C2CCC2)o1)N1CCc2[nH]cnc2C1c1cc2cccc(Cl)n2n1.

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

The InChIKey is HLCHVKWEAKMCKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN7O2/c21-15-6-2-5-12-9-14(26-28(12)15)17-16-13(22-10-23-16)7-8-27(17)20(29)19-25-24-18(30-19)11-3-1-4-11/h2,5-6,9-11,17H,1,3-4,7-8H2,(H,22,23).

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

[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone has a molecular weight of 423.86 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone is sourced from PubChem (CID 170332236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).