1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine

C102H68ClF13N24O3 — CID 158593741

About 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine

1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine (PubChem CID 158593741) has the molecular formula C102H68ClF13N24O3 and a molecular weight of 1960.26 g/mol. Its IUPAC name is 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine.

Molecular Properties

• Compound Name: 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine
• PubChem CID: 158593741
• Molecular Formula: C102H68ClF13N24O3
• Molecular Weight: 1960.26 g/mol
• Exact Mass: 1958.54
• IUPAC Name: 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine
• SMILES: COCCOc1cnccc1Nc1cc(-c2cc(C(F)(F)F)ccc2F)nc2ncccc12.Cc1ccn(-c2cc(Nc3ccncc3)c3cccnc3n2)n1.Fc1ccc(C(F)(F)F)cc1-c1cc(-n2ccc3cnccc32)c2cccnc2n1.Nc1cc(Nc2cc(-c3cc(C(F)(F)F)ccc3F)nc3ncccc23)ncn1.O=C1Cc2cnccc2N1c1cc(-c2cc(Cl)ccc2F)nc2ncccc12
• InChI: InChI=1S/C23H18F4N4O2.C22H12F4N4.C21H12ClFN4O.C19H12F4N6.C17H14N6/c1-32-9-10-33-21-13-28-8-6-18(21)30-19-12-20(31-22-15(19)3-2-7-29-22)16-11-14(23(25,26)27)4-5-17(16)24;23-17-4-3-14(22(24,25)26)10-16(17)18-11-20(15-2-1-7-28-21(15)29-18)30-9-6-13-12-27-8-5-19(13)30;22-13-3-4-16(23)15(9-13)17-10-19(14-2-1-6-25-21(14)26-17)27-18-5-7-24-11-12(18)8-20(27)28;20-13-4-3-10(19(21,22)23)6-12(13)15-7-14(11-2-1-5-25-18(11)29-15)28-17-8-16(24)26-9-27-17;1-12-6-10-23(22-12)16-11-15(20-13-4-8-18-9-5-13)14-3-2-7-19-17(14)21-16/h2-8,11-13H,9-10H2,1H3,(H,28,29,30,31);1-12H;1-7,9-11H,8H2;1-9H,(H3,24,25,26,27,28,29);2-11H,1H3,(H,18,19,20,21)
• InChIKey: HUTLHJCQYJFDPB-UHFFFAOYSA-N
• XLogP: 23.95
• TPSA: 329.87 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 26
• Rotatable Bonds: 17
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1960.26
LogP ≤ 5	23.95
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine?

The IUPAC name of 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine (CID 158593741) is 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine.

What is the SMILES notation for 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine?

The canonical SMILES for 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine is COCCOc1cnccc1Nc1cc(-c2cc(C(F)(F)F)ccc2F)nc2ncccc12.Cc1ccn(-c2cc(Nc3ccncc3)c3cccnc3n2)n1.Fc1ccc(C(F)(F)F)cc1-c1cc(-n2ccc3cnccc32)c2cccnc2n1.Nc1cc(Nc2cc(-c3cc(C(F)(F)F)ccc3F)nc3ncccc23)ncn1.O=C1Cc2cnccc2N1c1cc(-c2cc(Cl)ccc2F)nc2ncccc12.

What is the InChIKey of 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine?

The InChIKey is HUTLHJCQYJFDPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F4N4O2.C22H12F4N4.C21H12ClFN4O.C19H12F4N6.C17H14N6/c1-32-9-10-33-21-13-28-8-6-18(21)30-19-12-20(31-22-15(19)3-2-7-29-22)16-11-14(23(25,26)27)4-5-17(16)24;23-17-4-3-14(22(24,25)26)10-16(17)18-11-20(15-2-1-7-28-21(15)29-18)30-9-6-13-12-27-8-5-19(13)30;22-13-3-4-16(23)15(9-13)17-10-19(14-2-1-6-25-21(14)26-17)27-18-5-7-24-11-12(18)8-20(27)28;20-13-4-3-10(19(21,22)23)6-12(13)15-7-14(11-2-1-5-25-18(11)29-15)28-17-8-16(24)26-9-27-17;1-12-6-10-23(22-12)16-11-15(20-13-4-8-18-9-5-13)14-3-2-7-19-17(14)21-16/h2-8,11-13H,9-10H2,1H3,(H,28,29,30,31);1-12H;1-7,9-11H,8H2;1-9H,(H3,24,25,26,27,28,29);2-11H,1H3,(H,18,19,20,21).

What are the key properties of 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine?

1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine has a molecular weight of 1960.26 g/mol, XLogP of 23.95, 17 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-3H-pyrrolo[3,2-c]pyridin-2-one;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-[3-(2-methoxyethoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;4-N-[2-[2-fluoro-5-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-yl]pyrimidine-4,6-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-pyrrolo[3,2-c]pyridin-1-yl-1,8-naphthyridine;2-(3-methylpyrazol-1-yl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine is sourced from PubChem (CID 158593741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).