7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide

C108H101F10N9O9 — CID 159515049

About 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide

7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide (PubChem CID 159515049) has the molecular formula C108H101F10N9O9 and a molecular weight of 1859.03 g/mol. Its IUPAC name is 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide.

Molecular Properties

• Compound Name: 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide
• PubChem CID: 159515049
• Molecular Formula: C108H101F10N9O9
• Molecular Weight: 1859.03 g/mol
• Exact Mass: 1857.76
• IUPAC Name: 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide
• SMILES: C=C(O)C(C)(C)c1cccc(-c2ccc(CN(Cc3ccc(C(F)(F)F)o3)C(=O)c3c(C)c(C)nc4cc(C)c(C)nc34)cc2)c1.C=C(O)C(C)(C)c1cccc(-c2ccc(CN(Cc3ccc(C(F)(F)F)o3)C(=O)c3c(C)c(C)nc4cc(C)cnc34)cc2)c1.C=C(O)C(C)(C)c1cccc(-c2ccc(CN(Cc3ccc(C(F)(F)F)o3)C(=O)c3c(C)c(C)nc4cc(F)cnc34)cc2)c1
• InChI: InChI=1S/C37H36F3N3O3.C36H34F3N3O3.C35H31F4N3O3/c1-21-17-31-34(42-23(21)3)33(22(2)24(4)41-31)35(45)43(20-30-15-16-32(46-30)37(38,39)40)19-26-11-13-27(14-12-26)28-9-8-10-29(18-28)36(6,7)25(5)44;1-21-16-30-33(40-18-21)32(22(2)23(3)41-30)34(44)42(20-29-14-15-31(45-29)36(37,38)39)19-25-10-12-26(13-11-25)27-8-7-9-28(17-27)35(5,6)24(4)43;1-20-21(2)41-29-16-27(36)17-40-32(29)31(20)33(44)42(19-28-13-14-30(45-28)35(37,38)39)18-23-9-11-24(12-10-23)25-7-6-8-26(15-25)34(4,5)22(3)43/h8-18,44H,5,19-20H2,1-4,6-7H3;7-18,43H,4,19-20H2,1-3,5-6H3;6-17,43H,3,18-19H2,1-2,4-5H3
• InChIKey: MBBULQWVWSQSBD-UHFFFAOYSA-N
• XLogP: 27.22
• TPSA: 238.38 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 15
• Rotatable Bonds: 24
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1859.03
LogP ≤ 5	27.22
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide?

The IUPAC name of 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide (CID 159515049) is 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide.

What is the SMILES notation for 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide?

The canonical SMILES for 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide is C=C(O)C(C)(C)c1cccc(-c2ccc(CN(Cc3ccc(C(F)(F)F)o3)C(=O)c3c(C)c(C)nc4cc(C)c(C)nc34)cc2)c1.C=C(O)C(C)(C)c1cccc(-c2ccc(CN(Cc3ccc(C(F)(F)F)o3)C(=O)c3c(C)c(C)nc4cc(C)cnc34)cc2)c1.C=C(O)C(C)(C)c1cccc(-c2ccc(CN(Cc3ccc(C(F)(F)F)o3)C(=O)c3c(C)c(C)nc4cc(F)cnc34)cc2)c1.

What is the InChIKey of 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide?

The InChIKey is MBBULQWVWSQSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H36F3N3O3.C36H34F3N3O3.C35H31F4N3O3/c1-21-17-31-34(42-23(21)3)33(22(2)24(4)41-31)35(45)43(20-30-15-16-32(46-30)37(38,39)40)19-26-11-13-27(14-12-26)28-9-8-10-29(18-28)36(6,7)25(5)44;1-21-16-30-33(40-18-21)32(22(2)23(3)41-30)34(44)42(20-29-14-15-31(45-29)36(37,38)39)19-25-10-12-26(13-11-25)27-8-7-9-28(17-27)35(5,6)24(4)43;1-20-21(2)41-29-16-27(36)17-40-32(29)31(20)33(44)42(19-28-13-14-30(45-28)35(37,38)39)18-23-9-11-24(12-10-23)25-7-6-8-26(15-25)34(4,5)22(3)43/h8-18,44H,5,19-20H2,1-4,6-7H3;7-18,43H,4,19-20H2,1-3,5-6H3;6-17,43H,3,18-19H2,1-2,4-5H3.

What are the key properties of 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide?

7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide has a molecular weight of 1859.03 g/mol, XLogP of 27.22, 24 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 7-fluoro-N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3-dimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,6,7-tetramethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide;N-[[4-[3-(3-hydroxy-2-methylbut-3-en-2-yl)phenyl]phenyl]methyl]-2,3,7-trimethyl-N-[[5-(trifluoromethyl)furan-2-yl]methyl]-1,5-naphthyridine-4-carboxamide is sourced from PubChem (CID 159515049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).