5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C30H30F2N8O2 — CID 176704536

About 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 176704536) has the molecular formula C30H30F2N8O2 and a molecular weight of 572.62 g/mol. Its IUPAC name is 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
• PubChem CID: 176704536
• Molecular Formula: C30H30F2N8O2
• Molecular Weight: 572.62 g/mol
• Exact Mass: 572.25
• IUPAC Name: 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
• SMILES: C=C(/N=C(C)\C(=C(\C)N)c1ccn2ncc(C(=O)Nc3cc(-c4noc(C5CC5)n4)ccc3C)c2c1)N1CC(F)(F)C1
• InChI: InChI=1S/C30H30F2N8O2/c1-16-5-6-22(27-37-29(42-38-27)20-7-8-20)11-24(16)36-28(41)23-13-34-40-10-9-21(12-25(23)40)26(17(2)33)18(3)35-19(4)39-14-30(31,32)15-39/h5-6,9-13,20H,4,7-8,14-15,33H2,1-3H3,(H,36,41)/b26-17+,35-18-
• InChIKey: CODHDCOJZFTHRI-USIHWADFSA-N
• XLogP: 5.40
• TPSA: 126.94 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 8
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	572.62
LogP ≤ 5	5.40
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The IUPAC name of 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 176704536) is 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

What is the SMILES notation for 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The canonical SMILES for 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is C=C(/N=C(C)\C(=C(\C)N)c1ccn2ncc(C(=O)Nc3cc(-c4noc(C5CC5)n4)ccc3C)c2c1)N1CC(F)(F)C1.

What is the InChIKey of 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

The InChIKey is CODHDCOJZFTHRI-USIHWADFSA-N. The full InChI is InChI=1S/C30H30F2N8O2/c1-16-5-6-22(27-37-29(42-38-27)20-7-8-20)11-24(16)36-28(41)23-13-34-40-10-9-21(12-25(23)40)26(17(2)33)18(3)35-19(4)39-14-30(31,32)15-39/h5-6,9-13,20H,4,7-8,14-15,33H2,1-3H3,(H,36,41)/b26-17+,35-18-.

What are the key properties of 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?

5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 572.62 g/mol, XLogP of 5.40, 8 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(Z,4Z)-2-amino-4-[1-(3,3-difluoroazetidin-1-yl)ethenylimino]pent-2-en-3-yl]-N-[5-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 176704536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).