N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide

C32H26F2N6O3 — CID 59159910

About N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide

N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide (PubChem CID 59159910) has the molecular formula C32H26F2N6O3 and a molecular weight of 580.60 g/mol. Its IUPAC name is N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide
• PubChem CID: 59159910
• Molecular Formula: C32H26F2N6O3
• Molecular Weight: 580.60 g/mol
• Exact Mass: 580.20
• IUPAC Name: N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide
• SMILES: Cc1cc(-c2cc3[nH]ncc3cc2Oc2ccc(NC(=O)c3c(C)cc(C)n(-c4ccc(F)cc4)c3=O)cc2F)n(C)n1
• InChI: InChI=1S/C32H26F2N6O3/c1-17-11-19(3)40(23-8-5-21(33)6-9-23)32(42)30(17)31(41)36-22-7-10-28(25(34)14-22)43-29-13-20-16-35-37-26(20)15-24(29)27-12-18(2)38-39(27)4/h5-16H,1-4H3,(H,35,37)(H,36,41)
• InChIKey: SBEYDCBYWMMDPQ-UHFFFAOYSA-N
• XLogP: 6.36
• TPSA: 106.83 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 43
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	580.60
LogP ≤ 5	6.36
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?

The IUPAC name of N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide (CID 59159910) is N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide.

What is the SMILES notation for N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?

The canonical SMILES for N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide is Cc1cc(-c2cc3[nH]ncc3cc2Oc2ccc(NC(=O)c3c(C)cc(C)n(-c4ccc(F)cc4)c3=O)cc2F)n(C)n1.

What is the InChIKey of N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?

The InChIKey is SBEYDCBYWMMDPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26F2N6O3/c1-17-11-19(3)40(23-8-5-21(33)6-9-23)32(42)30(17)31(41)36-22-7-10-28(25(34)14-22)43-29-13-20-16-35-37-26(20)15-24(29)27-12-18(2)38-39(27)4/h5-16H,1-4H3,(H,35,37)(H,36,41).

What are the key properties of N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?

N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 580.60 g/mol, XLogP of 6.36, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[[6-(2,5-dimethylpyrazol-3-yl)-1H-indazol-5-yl]oxy]-3-fluorophenyl]-1-(4-fluorophenyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 59159910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).