N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one

C135H97N19O11S — CID 160946439

About N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one

N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one (PubChem CID 160946439) has the molecular formula C135H97N19O11S and a molecular weight of 2193.45 g/mol. Its IUPAC name is N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one.

Molecular Properties

• Compound Name: N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one
• PubChem CID: 160946439
• Molecular Formula: C135H97N19O11S
• Molecular Weight: 2193.45 g/mol
• Exact Mass: 2191.73
• IUPAC Name: N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one
• SMILES: C=CC(=O)N1CCc2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc21.C=CC(=O)Nc1cc(-n2c(=O)ccc3cnc4ccc(-c5cccnc5)cc4c32)ccc1C.C=CC(=O)Nc1cc(-n2c(=O)ccc3cnc4ccc(-c5ccoc5)cc4c32)ccc1C.C=CC(=O)Nc1cc(-n2c(=O)ccc3cnc4ccc(-c5ccsc5)cc4c32)ccc1C.C=CC(=O)Nc1cccc(-n2c(=O)ccc3cnc4ccc(-c5cn[nH]c5)cc4c32)c1
• InChI: InChI=1S/C32H22N4O2.C27H20N4O2.C26H19N3O3.C26H19N3O2S.C24H17N5O2/c1-2-30(37)35-14-13-20-7-10-25(17-29(20)35)36-31(38)12-9-23-18-34-28-11-8-21(16-26(28)32(23)36)24-15-22-5-3-4-6-27(22)33-19-24;1-3-25(32)30-24-14-21(9-6-17(24)2)31-26(33)11-8-20-16-29-23-10-7-18(13-22(23)27(20)31)19-5-4-12-28-15-19;2*1-3-24(30)28-23-13-20(7-4-16(23)2)29-25(31)9-6-18-14-27-22-8-5-17(12-21(22)26(18)29)19-10-11-32-15-19;1-2-22(30)28-18-4-3-5-19(11-18)29-23(31)9-7-16-12-25-21-8-6-15(10-20(21)24(16)29)17-13-26-27-14-17/h2-12,15-19H,1,13-14H2;3-16H,1H2,2H3,(H,30,32);2*3-15H,1H2,2H3,(H,28,30);2-14H,1H2,(H,26,27)(H,28,30)
• InChIKey: SVEGJCZUNZOSTE-UHFFFAOYSA-N
• XLogP: 25.85
• TPSA: 378.76 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 25
• Rotatable Bonds: 19
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2193.45
LogP ≤ 5	25.85
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one?

The IUPAC name of N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one (CID 160946439) is N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one.

What is the SMILES notation for N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one?

The canonical SMILES for N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one is C=CC(=O)N1CCc2ccc(-n3c(=O)ccc4cnc5ccc(-c6cnc7ccccc7c6)cc5c43)cc21.C=CC(=O)Nc1cc(-n2c(=O)ccc3cnc4ccc(-c5cccnc5)cc4c32)ccc1C.C=CC(=O)Nc1cc(-n2c(=O)ccc3cnc4ccc(-c5ccoc5)cc4c32)ccc1C.C=CC(=O)Nc1cc(-n2c(=O)ccc3cnc4ccc(-c5ccsc5)cc4c32)ccc1C.C=CC(=O)Nc1cccc(-n2c(=O)ccc3cnc4ccc(-c5cn[nH]c5)cc4c32)c1.

What is the InChIKey of N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one?

The InChIKey is SVEGJCZUNZOSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22N4O2.C27H20N4O2.C26H19N3O3.C26H19N3O2S.C24H17N5O2/c1-2-30(37)35-14-13-20-7-10-25(17-29(20)35)36-31(38)12-9-23-18-34-28-11-8-21(16-26(28)32(23)36)24-15-22-5-3-4-6-27(22)33-19-24;1-3-25(32)30-24-14-21(9-6-17(24)2)31-26(33)11-8-20-16-29-23-10-7-18(13-22(23)27(20)31)19-5-4-12-28-15-19;2*1-3-24(30)28-23-13-20(7-4-16(23)2)29-25(31)9-6-18-14-27-22-8-5-17(12-21(22)26(18)29)19-10-11-32-15-19;1-2-22(30)28-18-4-3-5-19(11-18)29-23(31)9-7-16-12-25-21-8-6-15(10-20(21)24(16)29)17-13-26-27-14-17/h2-12,15-19H,1,13-14H2;3-16H,1H2,2H3,(H,30,32);2*3-15H,1H2,2H3,(H,28,30);2-14H,1H2,(H,26,27)(H,28,30).

What are the key properties of N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one?

N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one has a molecular weight of 2193.45 g/mol, XLogP of 25.85, 19 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-[9-(furan-3-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-methylphenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-pyridin-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[2-methyl-5-(2-oxo-9-thiophen-3-ylbenzo[h][1,6]naphthyridin-1-yl)phenyl]prop-2-enamide;N-[3-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]phenyl]prop-2-enamide;1-(1-prop-2-enoyl-2,3-dihydroindol-6-yl)-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one is sourced from PubChem (CID 160946439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).