7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one

C119H103F4N17O10S — CID 158442978

About 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one

7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one (PubChem CID 158442978) has the molecular formula C119H103F4N17O10S and a molecular weight of 2039.30 g/mol. Its IUPAC name is 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one.

Molecular Properties

• Compound Name: 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one
• PubChem CID: 158442978
• Molecular Formula: C119H103F4N17O10S
• Molecular Weight: 2039.30 g/mol
• Exact Mass: 2037.77
• IUPAC Name: 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one
• SMILES: CC(C)CSc1cc(C(F)(F)F)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1.Cc1cc(C(=O)C(C)C)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1.Cc1nc2c(cc1CCC(=O)O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.Cc1nc2c(cc1CCC(N)=O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.NC(=O)c1nc2c(cc1F)c(=O)cc(Nc1ccccc1)n2-c1ccccc1
• InChI: InChI=1S/C25H22F3N3OS.C25H23N3O2.C24H22N4O2.C24H21N3O3.C21H15FN4O2/c1-16(2)15-33-22-13-19(25(26,27)28)23-20(32)14-21(29-17-9-5-3-6-10-17)31(24(23)30-22)18-11-7-4-8-12-18;1-16(2)24(30)20-14-17(3)23-21(29)15-22(26-18-10-6-4-7-11-18)28(25(23)27-20)19-12-8-5-9-13-19;1-16-17(12-13-22(25)30)14-20-21(29)15-23(27-18-8-4-2-5-9-18)28(24(20)26-16)19-10-6-3-7-11-19;1-16-17(12-13-23(29)30)14-20-21(28)15-22(26-18-8-4-2-5-9-18)27(24(20)25-16)19-10-6-3-7-11-19;22-16-11-15-17(27)12-18(24-13-7-3-1-4-8-13)26(14-9-5-2-6-10-14)21(15)25-19(16)20(23)28/h3-14,16,29H,15H2,1-2H3;4-16,26H,1-3H3;2-11,14-15,27H,12-13H2,1H3,(H2,25,30);2-11,14-15,26H,12-13H2,1H3,(H,29,30);1-12,24H,(H2,23,28)
• InChIKey: HDASCOUCFPTEIO-UHFFFAOYSA-N
• XLogP: 23.85
• TPSA: 375.15 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 25
• Rotatable Bonds: 27
• Heavy Atoms: 151
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2039.30
LogP ≤ 5	23.85
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one?

The IUPAC name of 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one (CID 158442978) is 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one.

What is the SMILES notation for 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one?

The canonical SMILES for 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one is CC(C)CSc1cc(C(F)(F)F)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1.Cc1cc(C(=O)C(C)C)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1.Cc1nc2c(cc1CCC(=O)O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.Cc1nc2c(cc1CCC(N)=O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.NC(=O)c1nc2c(cc1F)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.

What is the InChIKey of 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one?

The InChIKey is HDASCOUCFPTEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F3N3OS.C25H23N3O2.C24H22N4O2.C24H21N3O3.C21H15FN4O2/c1-16(2)15-33-22-13-19(25(26,27)28)23-20(32)14-21(29-17-9-5-3-6-10-17)31(24(23)30-22)18-11-7-4-8-12-18;1-16(2)24(30)20-14-17(3)23-21(29)15-22(26-18-10-6-4-7-11-18)28(25(23)27-20)19-12-8-5-9-13-19;1-16-17(12-13-22(25)30)14-20-21(29)15-23(27-18-8-4-2-5-9-18)28(24(20)26-16)19-10-6-3-7-11-19;1-16-17(12-13-23(29)30)14-20-21(28)15-22(26-18-8-4-2-5-9-18)27(24(20)25-16)19-10-6-3-7-11-19;22-16-11-15-17(27)12-18(24-13-7-3-1-4-8-13)26(14-9-5-2-6-10-14)21(15)25-19(16)20(23)28/h3-14,16,29H,15H2,1-2H3;4-16,26H,1-3H3;2-11,14-15,27H,12-13H2,1H3,(H2,25,30);2-11,14-15,26H,12-13H2,1H3,(H,29,30);1-12,24H,(H2,23,28).

What are the key properties of 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one?

7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one has a molecular weight of 2039.30 g/mol, XLogP of 23.85, 27 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 7-anilino-3-fluoro-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide;2-anilino-5-methyl-7-(2-methylpropanoyl)-1-phenyl-1,8-naphthyridin-4-one;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanamide;3-(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)propanoic acid;2-anilino-7-(2-methylpropylsulfanyl)-1-phenyl-5-(trifluoromethyl)-1,8-naphthyridin-4-one is sourced from PubChem (CID 158442978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).