1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide

C30H19F2N5O3 — CID 118203931

About 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide

1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide (PubChem CID 118203931) has the molecular formula C30H19F2N5O3 and a molecular weight of 535.51 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

• Compound Name: 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide
• PubChem CID: 118203931
• Molecular Formula: C30H19F2N5O3
• Molecular Weight: 535.51 g/mol
• Exact Mass: 535.15
• IUPAC Name: 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide
• SMILES: O=C(Nc1ccc(Oc2cc(-c3ccncc3)cn3nccc23)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O
• InChI: InChI=1S/C30H19F2N5O3/c31-21-3-6-23(7-4-21)36-15-1-2-24(30(36)39)29(38)35-22-5-8-27(25(32)17-22)40-28-16-20(19-9-12-33-13-10-19)18-37-26(28)11-14-34-37/h1-18H,(H,35,38)
• InChIKey: GFODQIAPQKSLPF-UHFFFAOYSA-N
• XLogP: 5.87
• TPSA: 90.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	535.51
LogP ≤ 5	5.87
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide?

The IUPAC name of 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide (CID 118203931) is 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide.

What is the SMILES notation for 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide?

The canonical SMILES for 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide is O=C(Nc1ccc(Oc2cc(-c3ccncc3)cn3nccc23)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O.

What is the InChIKey of 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide?

The InChIKey is GFODQIAPQKSLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19F2N5O3/c31-21-3-6-23(7-4-21)36-15-1-2-24(30(36)39)29(38)35-22-5-8-27(25(32)17-22)40-28-16-20(19-9-12-33-13-10-19)18-37-26(28)11-14-34-37/h1-18H,(H,35,38).

What are the key properties of 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide?

1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide has a molecular weight of 535.51 g/mol, XLogP of 5.87, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-fluorophenyl)-N-[3-fluoro-4-(6-pyridin-4-ylpyrazolo[1,5-a]pyridin-4-yl)oxyphenyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 118203931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).