2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline

C120H74N14 — CID 165071745

About 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline

2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline (PubChem CID 165071745) has the molecular formula C120H74N14 and a molecular weight of 1712.01 g/mol. Its IUPAC name is 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline.

Molecular Properties

• Compound Name: 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline
• PubChem CID: 165071745
• Molecular Formula: C120H74N14
• Molecular Weight: 1712.01 g/mol
• Exact Mass: 1710.62
• IUPAC Name: 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline
• SMILES: c1ccc(-c2ccc3ccc(-c4ccc5ccc(-c6cc(-c7cnc8ccccc8c7)cc(-c7cnc8ccccc8c7)c6)nc5c4)cc3n2)nc1.c1ccc(-c2ccc3ccc(-c4ccc5ccc(-c6ccc7ccc8cccnc8c7n6)nc5c4)cc3n2)nc1.c1ccc(-c2ccc3ccc(-c4ccc5ccc(-c6cccc(-c7cnc8ccccc8c7)c6)nc5c4)cc3n2)nc1
• InChI: InChI=1S/C47H29N5.C38H24N4.C35H21N5/c1-3-9-41-34(7-1)21-39(28-49-41)36-23-37(40-22-35-8-2-4-10-42(35)50-29-40)25-38(24-36)43-18-16-30-12-14-32(26-46(30)51-43)33-15-13-31-17-19-45(52-47(31)27-33)44-11-5-6-20-48-44;1-2-9-33-30(6-1)21-32(24-40-33)27-7-5-8-31(20-27)34-17-15-25-11-13-28(22-37(25)41-34)29-14-12-26-16-18-36(42-38(26)23-29)35-10-3-4-19-39-35;1-2-18-36-28(5-1)29-15-12-22-6-10-26(20-32(22)38-29)27-11-7-23-13-16-30(39-33(23)21-27)31-17-14-25-9-8-24-4-3-19-37-34(24)35(25)40-31/h1-29H;1-24H;1-21H
• InChIKey: SWNKWCSZIPKYLK-UHFFFAOYSA-N
• XLogP: 29.28
• TPSA: 180.46 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 12
• Heavy Atoms: 134
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1712.01
LogP ≤ 5	29.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline?

The IUPAC name of 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline (CID 165071745) is 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline.

What is the SMILES notation for 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline?

The canonical SMILES for 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline is c1ccc(-c2ccc3ccc(-c4ccc5ccc(-c6cc(-c7cnc8ccccc8c7)cc(-c7cnc8ccccc8c7)c6)nc5c4)cc3n2)nc1.c1ccc(-c2ccc3ccc(-c4ccc5ccc(-c6ccc7ccc8cccnc8c7n6)nc5c4)cc3n2)nc1.c1ccc(-c2ccc3ccc(-c4ccc5ccc(-c6cccc(-c7cnc8ccccc8c7)c6)nc5c4)cc3n2)nc1.

What is the InChIKey of 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline?

The InChIKey is SWNKWCSZIPKYLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H29N5.C38H24N4.C35H21N5/c1-3-9-41-34(7-1)21-39(28-49-41)36-23-37(40-22-35-8-2-4-10-42(35)50-29-40)25-38(24-36)43-18-16-30-12-14-32(26-46(30)51-43)33-15-13-31-17-19-45(52-47(31)27-33)44-11-5-6-20-48-44;1-2-9-33-30(6-1)21-32(24-40-33)27-7-5-8-31(20-27)34-17-15-25-11-13-28(22-37(25)41-34)29-14-12-26-16-18-36(42-38(26)23-29)35-10-3-4-19-39-35;1-2-18-36-28(5-1)29-15-12-22-6-10-26(20-32(22)38-29)27-11-7-23-13-16-30(39-33(23)21-27)31-17-14-25-9-8-24-4-3-19-37-34(24)35(25)40-31/h1-29H;1-24H;1-21H.

What are the key properties of 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline?

2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline has a molecular weight of 1712.01 g/mol, XLogP of 29.28, 12 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3,5-di(quinolin-3-yl)phenyl]-7-(2-pyridin-2-ylquinolin-7-yl)quinoline;2-pyridin-2-yl-7-[2-(3-quinolin-3-ylphenyl)quinolin-7-yl]quinoline;2-[7-(2-pyridin-2-ylquinolin-7-yl)quinolin-2-yl]-1,10-phenanthroline is sourced from PubChem (CID 165071745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).