4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one

C93H63ClF5N17O4 — CID 158725019

About 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one

4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one (PubChem CID 158725019) has the molecular formula C93H63ClF5N17O4 and a molecular weight of 1613.08 g/mol. Its IUPAC name is 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one.

Molecular Properties

• Compound Name: 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one
• PubChem CID: 158725019
• Molecular Formula: C93H63ClF5N17O4
• Molecular Weight: 1613.08 g/mol
• Exact Mass: 1611.49
• IUPAC Name: 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one
• SMILES: Cc1occc1-c1cc(C2=CCc3cnccc32)c2cccnc2n1.Nc1nccc2c(-c3cc(-c4c(F)cccc4F)nc4ncccc34)nccc12.O=c1[nH]cc(-c2cc(-c3cc(F)ccc3F)nc3ncccc23)c2ccncc12.O=c1cc(-c2cc(-c3cc(Cl)ccc3F)nc3ncccc23)c2ccncc2n1CCN1CCOCC1
• InChI: InChI=1S/C28H23ClFN5O2.C22H13F2N5.C22H12F2N4O.C21H15N3O/c29-18-3-4-24(30)23(14-18)25-15-21(20-2-1-6-32-28(20)33-25)22-16-27(36)35(26-17-31-7-5-19(22)26)9-8-34-10-12-37-13-11-34;23-16-4-1-5-17(24)19(16)18-11-15(14-3-2-8-28-22(14)29-18)20-12-6-10-27-21(25)13(12)7-9-26-20;23-12-3-4-19(24)16(8-12)20-9-15(14-2-1-6-26-21(14)28-20)17-11-27-22(29)18-10-25-7-5-13(17)18;1-13-15(7-10-25-13)20-11-19(18-3-2-8-23-21(18)24-20)17-5-4-14-12-22-9-6-16(14)17/h1-7,14-17H,8-13H2;1-11H,(H2,25,27);1-11H,(H,27,29);2-3,5-12H,4H2,1H3
• InChIKey: IKJWYALHCDFIPS-UHFFFAOYSA-N
• XLogP: 18.63
• TPSA: 274.06 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 20
• Rotatable Bonds: 11
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1613.08
LogP ≤ 5	18.63
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one?

The IUPAC name of 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one (CID 158725019) is 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one.

What is the SMILES notation for 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one?

The canonical SMILES for 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one is Cc1occc1-c1cc(C2=CCc3cnccc32)c2cccnc2n1.Nc1nccc2c(-c3cc(-c4c(F)cccc4F)nc4ncccc34)nccc12.O=c1[nH]cc(-c2cc(-c3cc(F)ccc3F)nc3ncccc23)c2ccncc12.O=c1cc(-c2cc(-c3cc(Cl)ccc3F)nc3ncccc23)c2ccncc2n1CCN1CCOCC1.

What is the InChIKey of 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one?

The InChIKey is IKJWYALHCDFIPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23ClFN5O2.C22H13F2N5.C22H12F2N4O.C21H15N3O/c29-18-3-4-24(30)23(14-18)25-15-21(20-2-1-6-32-28(20)33-25)22-16-27(36)35(26-17-31-7-5-19(22)26)9-8-34-10-12-37-13-11-34;23-16-4-1-5-17(24)19(16)18-11-15(14-3-2-8-28-22(14)29-18)20-12-6-10-27-21(25)13(12)7-9-26-20;23-12-3-4-19(24)16(8-12)20-9-15(14-2-1-6-26-21(14)28-20)17-11-27-22(29)18-10-25-7-5-13(17)18;1-13-15(7-10-25-13)20-11-19(18-3-2-8-23-21(18)24-20)17-5-4-14-12-22-9-6-16(14)17/h1-7,14-17H,8-13H2;1-11H,(H2,25,27);1-11H,(H,27,29);2-3,5-12H,4H2,1H3.

What are the key properties of 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one?

4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one has a molecular weight of 1613.08 g/mol, XLogP of 18.63, 11 rotatable bonds, 2 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-1-(2-morpholin-4-ylethyl)-1,7-naphthyridin-2-one;4-(7H-cyclopenta[c]pyridin-5-yl)-2-(2-methylfuran-3-yl)-1,8-naphthyridine;5-[2-(2,6-difluorophenyl)-1,8-naphthyridin-4-yl]-2,6-naphthyridin-1-amine;4-[2-(2,5-difluorophenyl)-1,8-naphthyridin-4-yl]-2H-2,7-naphthyridin-1-one is sourced from PubChem (CID 158725019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).