2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine

C82H76F11IN16O11 — CID 160980155

About 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine

2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine (PubChem CID 160980155) has the molecular formula C82H76F11IN16O11 and a molecular weight of 1797.49 g/mol. Its IUPAC name is 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine.

Molecular Properties

• Compound Name: 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine
• PubChem CID: 160980155
• Molecular Formula: C82H76F11IN16O11
• Molecular Weight: 1797.49 g/mol
• Exact Mass: 1796.47
• IUPAC Name: 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine
• SMILES: CC(F)(F)C(=O)N[C@H]1CC(=O)N[C@@H]1c1ccc(F)cc1.CC(F)(F)C(=O)O.CN.Cn1cc(-n2ncc3cc(I)ccc32)ccc1=O.Cn1cc(-n2ncc3cc(N4C(=O)C[C@@H](NC(=O)C(C)(F)F)[C@@H]4c4ccc(F)cc4)ccc32)ccc1=O.Cn1cc(-n2ncc3cc(N4C(=O)C[C@H](NC(=O)C(C)(F)F)[C@H]4c4ccc(F)cc4)ccc32)ccc1=O
• InChI: InChI=1S/2C26H22F3N5O3.C13H13F3N2O2.C13H10IN3O.C3H4F2O2.CH5N/c2*1-26(28,29)25(37)31-20-12-23(36)33(24(20)15-3-5-17(27)6-4-15)18-7-9-21-16(11-18)13-30-34(21)19-8-10-22(35)32(2)14-19;1-13(15,16)12(20)17-9-6-10(19)18-11(9)7-2-4-8(14)5-3-7;1-16-8-11(3-5-13(16)18)17-12-4-2-10(14)6-9(12)7-15-17;1-3(4,5)2(6)7;1-2/h2*3-11,13-14,20,24H,12H2,1-2H3,(H,31,37);2-5,9,11H,6H2,1H3,(H,17,20)(H,18,19);2-8H,1H3;1H3,(H,6,7);2H2,1H3/t2*20-,24+;9-,11+;;;/m100.../s1
• InChIKey: SZKGHUWIDDDYMX-VFSMRFKRSA-N
• XLogP: 11.12
• TPSA: 339.80 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 20
• Rotatable Bonds: 15
• Heavy Atoms: 121
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1797.49
LogP ≤ 5	11.12
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine?

The IUPAC name of 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine (CID 160980155) is 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine.

What is the SMILES notation for 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine?

The canonical SMILES for 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine is CC(F)(F)C(=O)N[C@H]1CC(=O)N[C@@H]1c1ccc(F)cc1.CC(F)(F)C(=O)O.CN.Cn1cc(-n2ncc3cc(I)ccc32)ccc1=O.Cn1cc(-n2ncc3cc(N4C(=O)C[C@@H](NC(=O)C(C)(F)F)[C@@H]4c4ccc(F)cc4)ccc32)ccc1=O.Cn1cc(-n2ncc3cc(N4C(=O)C[C@H](NC(=O)C(C)(F)F)[C@H]4c4ccc(F)cc4)ccc32)ccc1=O.

What is the InChIKey of 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine?

The InChIKey is SZKGHUWIDDDYMX-VFSMRFKRSA-N. The full InChI is InChI=1S/2C26H22F3N5O3.C13H13F3N2O2.C13H10IN3O.C3H4F2O2.CH5N/c2*1-26(28,29)25(37)31-20-12-23(36)33(24(20)15-3-5-17(27)6-4-15)18-7-9-21-16(11-18)13-30-34(21)19-8-10-22(35)32(2)14-19;1-13(15,16)12(20)17-9-6-10(19)18-11(9)7-2-4-8(14)5-3-7;1-16-8-11(3-5-13(16)18)17-12-4-2-10(14)6-9(12)7-15-17;1-3(4,5)2(6)7;1-2/h2*3-11,13-14,20,24H,12H2,1-2H3,(H,31,37);2-5,9,11H,6H2,1H3,(H,17,20)(H,18,19);2-8H,1H3;1H3,(H,6,7);2H2,1H3/t2*20-,24+;9-,11+;;;/m100.../s1.

What are the key properties of 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine?

2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine has a molecular weight of 1797.49 g/mol, XLogP of 11.12, 15 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2-difluoro-N-[(2S,3R)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-1-[1-(1-methyl-6-oxo-3-pyridinyl)indazol-5-yl]-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoro-N-[(2R,3S)-2-(4-fluorophenyl)-5-oxopyrrolidin-3-yl]propanamide;2,2-difluoropropanoic acid;5-(5-iodoindazol-1-yl)-1-methylpyridin-2-one;methanamine is sourced from PubChem (CID 160980155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).