3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine

C89H53Cl2F5N16O — CID 159738974

About 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine

3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine (PubChem CID 159738974) has the molecular formula C89H53Cl2F5N16O and a molecular weight of 1528.41 g/mol. Its IUPAC name is 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine.

Molecular Properties

• Compound Name: 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine
• PubChem CID: 159738974
• Molecular Formula: C89H53Cl2F5N16O
• Molecular Weight: 1528.41 g/mol
• Exact Mass: 1526.39
• IUPAC Name: 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine
• SMILES: Fc1ccc(Cl)cc1-c1cc(-c2coc3cnccc23)c2cccnc2n1.Nc1nccc2c(-c3cc(-c4cc(Cl)ccc4F)nc4ncccc34)nccc12.Nc1nccc2c(-c3cc(-c4cc(F)ccc4F)nc4ncccc34)cccc12.Nc1nccc2c(-c3cc(-c4ccccc4F)nc4ncccc34)cccc12
• InChI: InChI=1S/C23H14F2N4.C23H15FN4.C22H13ClFN5.C21H11ClFN3O/c24-13-6-7-20(25)19(11-13)21-12-18(17-5-2-9-28-23(17)29-21)14-3-1-4-16-15(14)8-10-27-22(16)26;24-20-9-2-1-5-18(20)21-13-19(17-8-4-11-27-23(17)28-21)14-6-3-7-16-15(14)10-12-26-22(16)25;23-12-3-4-18(24)17(10-12)19-11-16(15-2-1-7-28-22(15)29-19)20-13-5-9-27-21(25)14(13)6-8-26-20;22-12-3-4-18(23)16(8-12)19-9-15(14-2-1-6-25-21(14)26-19)17-11-27-20-10-24-7-5-13(17)20/h1-12H,(H2,26,27);1-13H,(H2,25,26);1-11H,(H2,25,27);1-11H
• InChIKey: NCEXCVZGNNJQQF-UHFFFAOYSA-N
• XLogP: 21.78
• TPSA: 258.77 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 17
• Rotatable Bonds: 8
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1528.41
LogP ≤ 5	21.78
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	17

Frequently Asked Questions

What is the IUPAC name of 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine?

The IUPAC name of 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine (CID 159738974) is 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine.

What is the SMILES notation for 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine?

The canonical SMILES for 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine is Fc1ccc(Cl)cc1-c1cc(-c2coc3cnccc23)c2cccnc2n1.Nc1nccc2c(-c3cc(-c4cc(Cl)ccc4F)nc4ncccc34)nccc12.Nc1nccc2c(-c3cc(-c4cc(F)ccc4F)nc4ncccc34)cccc12.Nc1nccc2c(-c3cc(-c4ccccc4F)nc4ncccc34)cccc12.

What is the InChIKey of 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine?

The InChIKey is NCEXCVZGNNJQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14F2N4.C23H15FN4.C22H13ClFN5.C21H11ClFN3O/c24-13-6-7-20(25)19(11-13)21-12-18(17-5-2-9-28-23(17)29-21)14-3-1-4-16-15(14)8-10-27-22(16)26;24-20-9-2-1-5-18(20)21-13-19(17-8-4-11-27-23(17)28-21)14-6-3-7-16-15(14)10-12-26-22(16)25;23-12-3-4-18(24)17(10-12)19-11-16(15-2-1-7-28-22(15)29-19)20-13-5-9-27-21(25)14(13)6-8-26-20;22-12-3-4-18(23)16(8-12)19-9-15(14-2-1-6-25-21(14)26-19)17-11-27-20-10-24-7-5-13(17)20/h1-12H,(H2,26,27);1-13H,(H2,25,26);1-11H,(H2,25,27);1-11H.

What are the key properties of 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine?

3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine has a molecular weight of 1528.41 g/mol, XLogP of 21.78, 8 rotatable bonds, 3 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]furo[2,3-c]pyridine;5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;5-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine;5-[2-(2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-1-amine is sourced from PubChem (CID 159738974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).