6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline

C120H104F3N19O2 — CID 157467414

About 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline

6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline (PubChem CID 157467414) has the molecular formula C120H104F3N19O2 and a molecular weight of 1901.28 g/mol. Its IUPAC name is 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline.

Molecular Properties

• Compound Name: 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline
• PubChem CID: 157467414
• Molecular Formula: C120H104F3N19O2
• Molecular Weight: 1901.28 g/mol
• Exact Mass: 1899.86
• IUPAC Name: 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline
• SMILES: COc1cc(-c2ncccc2-c2ccc3cnn(C)c3c2)ccc1F.Cc1ccc(F)c(-c2ncccc2-c2ccc3cnn(C)c3c2)c1.[H]/N=C/c1ccc(-c2cccnc2-c2ccc(F)c(C)c2)cc1NC.[H]/N=C/c1ccc(-c2cccnc2-c2cccc(C#N)c2)cc1NC.[H]/N=C/c1ccc(-c2cccnc2-c2cccc(C)c2)cc1NC.[H]/N=C/c1ccc(-c2cccnc2-c2cccc(OC)c2)cc1NC
• InChI: InChI=1S/C20H16FN3O.C20H16FN3.C20H18FN3.C20H16N4.C20H19N3O.C20H19N3/c1-24-18-10-13(5-6-15(18)12-23-24)16-4-3-9-22-20(16)14-7-8-17(21)19(11-14)25-2;1-13-5-8-18(21)17(10-13)20-16(4-3-9-22-20)14-6-7-15-12-23-24(2)19(15)11-14;1-13-10-15(7-8-18(13)21)20-17(4-3-9-24-20)14-5-6-16(12-22)19(11-14)23-2;1-23-19-11-15(7-8-17(19)13-22)18-6-3-9-24-20(18)16-5-2-4-14(10-16)12-21;1-22-19-12-14(8-9-16(19)13-21)18-7-4-10-23-20(18)15-5-3-6-17(11-15)24-2;1-14-5-3-6-16(11-14)20-18(7-4-10-23-20)15-8-9-17(13-21)19(12-15)22-2/h3-12H,1-2H3;3-12H,1-2H3;3-12,22-23H,1-2H3;2-11,13,22-23H,1H3;3-13,21-22H,1-2H3;3-13,21-22H,1-2H3/b;;22-12+;22-13+;2*21-13+
• InChIKey: BUQIXILYRBWCBC-URAGUGHTSA-N
• XLogP: 27.66
• TPSA: 298.75 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 21
• Rotatable Bonds: 22
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1901.28
LogP ≤ 5	27.66
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline?

The IUPAC name of 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline (CID 157467414) is 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline.

What is the SMILES notation for 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline?

The canonical SMILES for 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline is COc1cc(-c2ncccc2-c2ccc3cnn(C)c3c2)ccc1F.Cc1ccc(F)c(-c2ncccc2-c2ccc3cnn(C)c3c2)c1.[H]/N=C/c1ccc(-c2cccnc2-c2ccc(F)c(C)c2)cc1NC.[H]/N=C/c1ccc(-c2cccnc2-c2cccc(C#N)c2)cc1NC.[H]/N=C/c1ccc(-c2cccnc2-c2cccc(C)c2)cc1NC.[H]/N=C/c1ccc(-c2cccnc2-c2cccc(OC)c2)cc1NC.

What is the InChIKey of 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline?

The InChIKey is BUQIXILYRBWCBC-URAGUGHTSA-N. The full InChI is InChI=1S/C20H16FN3O.C20H16FN3.C20H18FN3.C20H16N4.C20H19N3O.C20H19N3/c1-24-18-10-13(5-6-15(18)12-23-24)16-4-3-9-22-20(16)14-7-8-17(21)19(11-14)25-2;1-13-5-8-18(21)17(10-13)20-16(4-3-9-22-20)14-6-7-15-12-23-24(2)19(15)11-14;1-13-10-15(7-8-18(13)21)20-17(4-3-9-24-20)14-5-6-16(12-22)19(11-14)23-2;1-23-19-11-15(7-8-17(19)13-22)18-6-3-9-24-20(18)16-5-2-4-14(10-16)12-21;1-22-19-12-14(8-9-16(19)13-21)18-7-4-10-23-20(18)15-5-3-6-17(11-15)24-2;1-14-5-3-6-16(11-14)20-18(7-4-10-23-20)15-8-9-17(13-21)19(12-15)22-2/h3-12H,1-2H3;3-12H,1-2H3;3-12,22-23H,1-2H3;2-11,13,22-23H,1H3;3-13,21-22H,1-2H3;3-13,21-22H,1-2H3/b;;22-12+;22-13+;2*21-13+.

What are the key properties of 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline?

6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline has a molecular weight of 1901.28 g/mol, XLogP of 27.66, 22 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[2-(4-fluoro-3-methoxyphenyl)-3-pyridinyl]-1-methylindazole;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-2-methanimidoyl-N-methylaniline;6-[2-(2-fluoro-5-methylphenyl)-3-pyridinyl]-1-methylindazole;2-methanimidoyl-5-[2-(3-methoxyphenyl)-3-pyridinyl]-N-methylaniline;3-[3-[4-methanimidoyl-3-(methylamino)phenyl]-2-pyridinyl]benzonitrile;2-methanimidoyl-N-methyl-5-[2-(3-methylphenyl)-3-pyridinyl]aniline is sourced from PubChem (CID 157467414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).