2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline

C168H134N26O3 — CID 158947937

About 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline

2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline (PubChem CID 158947937) has the molecular formula C168H134N26O3 and a molecular weight of 2565.10 g/mol. Its IUPAC name is 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline.

Molecular Properties

• Compound Name: 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline
• PubChem CID: 158947937
• Molecular Formula: C168H134N26O3
• Molecular Weight: 2565.10 g/mol
• Exact Mass: 2563.11
• IUPAC Name: 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline
• SMILES: COc1cccc2ccc(CCc3ccc4ccc5cccnc5c4n3)nc12.O=C1CC(CCC2=NN=C(c3ccccc3)C2)=Nc2ccccc21.O=c1[nH]c(CCC2=NC(c3ccccc3)=CC2)cc2ccccc12.c1ccc(-c2cccc(CCc3cnc4ccccc4n3)n2)cc1.c1ccc(-n2ccc(CCc3cnc4ccccc4n3)n2)cc1.c1ccc2nc(CCc3ccc4ccc5cccnc5c4n3)ccc2c1.c1ccc2nc(CCc3cnc4ccccc4n3)cnc2c1.c1cnc2c(c1)ccc1ccc(CCc3cnc4ccccc4n3)nc12
• InChI: InChI=1S/C24H19N3O.C23H17N3.C22H16N4.C21H17N3.C21H18N2O.C20H17N3O.C19H16N4.C18H14N4/c1-28-21-6-2-4-16-9-11-19(26-22(16)21)13-14-20-12-10-18-8-7-17-5-3-15-25-23(17)24(18)27-20;1-2-6-21-16(4-1)9-11-19(25-21)13-14-20-12-10-18-8-7-17-5-3-15-24-22(17)23(18)26-20;1-2-6-20-19(5-1)24-14-18(25-20)12-11-17-10-9-16-8-7-15-4-3-13-23-21(15)22(16)26-17;1-2-7-16(8-3-1)19-12-6-9-17(23-19)13-14-18-15-22-20-10-4-5-11-21(20)24-18;24-21-19-9-5-4-8-16(19)14-18(23-21)11-10-17-12-13-20(22-17)15-6-2-1-3-7-15;24-20-13-15(21-18-9-5-4-8-17(18)20)10-11-16-12-19(23-22-16)14-6-2-1-3-7-14;1-2-6-17(7-3-1)23-13-12-15(22-23)10-11-16-14-20-18-8-4-5-9-19(18)21-16;1-3-7-17-15(5-1)19-11-13(21-17)9-10-14-12-20-16-6-2-4-8-18(16)22-14/h2-12,15H,13-14H2,1H3;1-12,15H,13-14H2;1-10,13-14H,11-12H2;1-12,15H,13-14H2;1-9,13-14H,10-12H2,(H,23,24);1-9H,10-13H2;1-9,12-14H,10-11H2;1-8,11-12H,9-10H2
• InChIKey: JLBDKWVQWMKBRM-UHFFFAOYSA-N
• XLogP: 34.91
• TPSA: 371.33 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 28
• Rotatable Bonds: 29
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2565.10
LogP ≤ 5	34.91
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline?

The IUPAC name of 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline (CID 158947937) is 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline.

What is the SMILES notation for 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline?

The canonical SMILES for 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline is COc1cccc2ccc(CCc3ccc4ccc5cccnc5c4n3)nc12.O=C1CC(CCC2=NN=C(c3ccccc3)C2)=Nc2ccccc21.O=c1[nH]c(CCC2=NC(c3ccccc3)=CC2)cc2ccccc12.c1ccc(-c2cccc(CCc3cnc4ccccc4n3)n2)cc1.c1ccc(-n2ccc(CCc3cnc4ccccc4n3)n2)cc1.c1ccc2nc(CCc3ccc4ccc5cccnc5c4n3)ccc2c1.c1ccc2nc(CCc3cnc4ccccc4n3)cnc2c1.c1cnc2c(c1)ccc1ccc(CCc3cnc4ccccc4n3)nc12.

What is the InChIKey of 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline?

The InChIKey is JLBDKWVQWMKBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O.C23H17N3.C22H16N4.C21H17N3.C21H18N2O.C20H17N3O.C19H16N4.C18H14N4/c1-28-21-6-2-4-16-9-11-19(26-22(16)21)13-14-20-12-10-18-8-7-17-5-3-15-25-23(17)24(18)27-20;1-2-6-21-16(4-1)9-11-19(25-21)13-14-20-12-10-18-8-7-17-5-3-15-24-22(17)23(18)26-20;1-2-6-20-19(5-1)24-14-18(25-20)12-11-17-10-9-16-8-7-15-4-3-13-23-21(15)22(16)26-17;1-2-7-16(8-3-1)19-12-6-9-17(23-19)13-14-18-15-22-20-10-4-5-11-21(20)24-18;24-21-19-9-5-4-8-16(19)14-18(23-21)11-10-17-12-13-20(22-17)15-6-2-1-3-7-15;24-20-13-15(21-18-9-5-4-8-17(18)20)10-11-16-12-19(23-22-16)14-6-2-1-3-7-14;1-2-6-17(7-3-1)23-13-12-15(22-23)10-11-16-14-20-18-8-4-5-9-19(18)21-16;1-3-7-17-15(5-1)19-11-13(21-17)9-10-14-12-20-16-6-2-4-8-18(16)22-14/h2-12,15H,13-14H2,1H3;1-12,15H,13-14H2;1-10,13-14H,11-12H2;1-12,15H,13-14H2;1-9,13-14H,10-12H2,(H,23,24);1-9H,10-13H2;1-9,12-14H,10-11H2;1-8,11-12H,9-10H2.

What are the key properties of 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline?

2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline has a molecular weight of 2565.10 g/mol, XLogP of 34.91, 29 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-(8-methoxyquinolin-2-yl)ethyl]-1,10-phenanthroline;2-[2-(5-phenyl-4H-pyrazol-3-yl)ethyl]-3H-quinolin-4-one;2-[2-(1-phenylpyrazol-3-yl)ethyl]quinoxaline;2-[2-(6-phenyl-2-pyridinyl)ethyl]quinoxaline;3-[2-(5-phenyl-3H-pyrrol-2-yl)ethyl]-2H-isoquinolin-1-one;2-(2-quinolin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)-1,10-phenanthroline;2-(2-quinoxalin-2-ylethyl)quinoxaline is sourced from PubChem (CID 158947937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).