1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile

C138H117F6N27O6 — CID 158054299

About 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile

1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile (PubChem CID 158054299) has the molecular formula C138H117F6N27O6 and a molecular weight of 2363.62 g/mol. Its IUPAC name is 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile.

Molecular Properties

• Compound Name: 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile
• PubChem CID: 158054299
• Molecular Formula: C138H117F6N27O6
• Molecular Weight: 2363.62 g/mol
• Exact Mass: 2361.96
• IUPAC Name: 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile
• SMILES: Cc1cc(C#N)c(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)nc2)c1.Cc1cc(C)c(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)cn2)c1.Cc1cc(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)cn2)cc1C.Cc1cc(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)nc2)cc1C.[C-]#[N+]c1c(C)ccc(F)c1CC(=O)Cc1ccc(-c2cccc3[nH]nc(N)c23)cn1.[C-]#[N+]c1c(C)ccc(F)c1CC(=O)Cc1ccc(-c2cccc3[nH]nc(N)c23)nc1
• InChI: InChI=1S/3C23H18FN5O.3C23H21FN4O/c1-13-6-9-19(24)18(22(13)26-2)11-16(30)10-15-8-7-14(12-27-15)17-4-3-5-20-21(17)23(25)29-28-20;1-13-6-8-18(24)17(22(13)26-2)11-15(30)10-14-7-9-19(27-12-14)16-4-3-5-20-21(16)23(25)29-28-20;1-13-7-15(22(24)16(8-13)11-25)10-17(30)9-14-5-6-19(27-12-14)18-3-2-4-20-21(18)23(26)29-28-20;1-13-8-16(20(24)9-14(13)2)10-18(29)11-17-7-6-15(12-26-17)19-4-3-5-21-22(19)23(25)28-27-21;1-13-8-16(19(24)9-14(13)2)11-17(29)10-15-6-7-20(26-12-15)18-4-3-5-21-22(18)23(25)28-27-21;1-13-8-14(2)22(24)16(9-13)10-18(29)11-17-7-6-15(12-26-17)19-4-3-5-20-21(19)23(25)28-27-20/h2*3-9,12H,10-11H2,1H3,(H3,25,28,29);2-8,12H,9-10H2,1H3,(H3,26,28,29);3*3-9,12H,10-11H2,1-2H3,(H3,25,27,28)
• InChIKey: FJVXMGHTIWRWQB-UHFFFAOYSA-N
• XLogP: 25.95
• TPSA: 540.47 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 25
• Rotatable Bonds: 30
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2363.62
LogP ≤ 5	25.95
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile?

The IUPAC name of 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile (CID 158054299) is 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile.

What is the SMILES notation for 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile?

The canonical SMILES for 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile is Cc1cc(C#N)c(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)nc2)c1.Cc1cc(C)c(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)cn2)c1.Cc1cc(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)cn2)cc1C.Cc1cc(F)c(CC(=O)Cc2ccc(-c3cccc4[nH]nc(N)c34)nc2)cc1C.[C-]#[N+]c1c(C)ccc(F)c1CC(=O)Cc1ccc(-c2cccc3[nH]nc(N)c23)cn1.[C-]#[N+]c1c(C)ccc(F)c1CC(=O)Cc1ccc(-c2cccc3[nH]nc(N)c23)nc1.

What is the InChIKey of 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile?

The InChIKey is FJVXMGHTIWRWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C23H18FN5O.3C23H21FN4O/c1-13-6-9-19(24)18(22(13)26-2)11-16(30)10-15-8-7-14(12-27-15)17-4-3-5-20-21(17)23(25)29-28-20;1-13-6-8-18(24)17(22(13)26-2)11-15(30)10-14-7-9-19(27-12-14)16-4-3-5-20-21(16)23(25)29-28-20;1-13-7-15(22(24)16(8-13)11-25)10-17(30)9-14-5-6-19(27-12-14)18-3-2-4-20-21(18)23(26)29-28-20;1-13-8-16(20(24)9-14(13)2)10-18(29)11-17-7-6-15(12-26-17)19-4-3-5-21-22(19)23(25)28-27-21;1-13-8-16(19(24)9-14(13)2)11-17(29)10-15-6-7-20(26-12-15)18-4-3-5-21-22(18)23(25)28-27-21;1-13-8-14(2)22(24)16(9-13)10-18(29)11-17-7-6-15(12-26-17)19-4-3-5-20-21(19)23(25)28-27-20/h2*3-9,12H,10-11H2,1H3,(H3,25,28,29);2-8,12H,9-10H2,1H3,(H3,26,28,29);3*3-9,12H,10-11H2,1-2H3,(H3,25,27,28).

What are the key properties of 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile?

1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile has a molecular weight of 2363.62 g/mol, XLogP of 25.95, 30 rotatable bonds, 12 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-3,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(2-fluoro-4,5-dimethylphenyl)propan-2-one;1-[5-(3-amino-1H-indazol-4-yl)-2-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;1-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-3-(6-fluoro-2-isocyano-3-methylphenyl)propan-2-one;3-[3-[6-(3-amino-1H-indazol-4-yl)-3-pyridinyl]-2-oxopropyl]-2-fluoro-5-methylbenzonitrile is sourced from PubChem (CID 158054299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).