6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide

C126H114Cl2F6N18O14 — CID 158101315

About 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide

6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide (PubChem CID 158101315) has the molecular formula C126H114Cl2F6N18O14 and a molecular weight of 2289.30 g/mol. Its IUPAC name is 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide.

Molecular Properties

• Compound Name: 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide
• PubChem CID: 158101315
• Molecular Formula: C126H114Cl2F6N18O14
• Molecular Weight: 2289.30 g/mol
• Exact Mass: 2286.80
• IUPAC Name: 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide
• SMILES: COc1cc2c(Nc3ccc4c(C(=O)Nc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Nc3ccc4c(C(=O)Nc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N)CC1.COc1cc2c(Nc3ccc4c(C(=O)Nc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Nc3ccc4c(C(=O)Nc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N)CC1
• InChI: InChI=1S/C34H30ClF3N4O3.C32H26ClF3N4O3.C31H31N5O4.C29H27N5O4/c1-42(2)33(12-13-33)19-45-31-18-29-25(17-30(31)44-3)28(11-14-39-29)40-21-7-9-23-20(15-21)5-4-6-24(23)32(43)41-22-8-10-27(35)26(16-22)34(36,37)38;1-42-28-15-23-26(9-12-38-27(23)16-29(28)43-17-31(37)10-11-31)39-19-5-7-21-18(13-19)3-2-4-22(21)30(41)40-20-6-8-25(33)24(14-20)32(34,35)36;1-19-14-29(35-40-19)34-30(37)23-7-5-6-20-15-21(8-9-22(20)23)33-25-10-13-32-26-17-28(27(38-4)16-24(25)26)39-18-31(11-12-31)36(2)3;1-17-12-27(34-38-17)33-28(35)21-5-3-4-18-13-19(6-7-20(18)21)32-23-8-11-31-24-15-26(25(36-2)14-22(23)24)37-16-29(30)9-10-29/h4-11,14-18H,12-13,19H2,1-3H3,(H,39,40)(H,41,43);2-9,12-16H,10-11,17,37H2,1H3,(H,38,39)(H,40,41);5-10,13-17H,11-12,18H2,1-4H3,(H,32,33)(H,34,35,37);3-8,11-15H,9-10,16,30H2,1-2H3,(H,31,32)(H,33,34,35)
• InChIKey: FPHFYADRVDBUKG-UHFFFAOYSA-N
• XLogP: 28.19
• TPSA: 400.50 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 28
• Rotatable Bonds: 34
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2289.30
LogP ≤ 5	28.19
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide?

The IUPAC name of 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide (CID 158101315) is 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide.

What is the SMILES notation for 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide?

The canonical SMILES for 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide is COc1cc2c(Nc3ccc4c(C(=O)Nc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Nc3ccc4c(C(=O)Nc5cc(C)on5)cccc4c3)ccnc2cc1OCC1(N)CC1.COc1cc2c(Nc3ccc4c(C(=O)Nc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N(C)C)CC1.COc1cc2c(Nc3ccc4c(C(=O)Nc5ccc(Cl)c(C(F)(F)F)c5)cccc4c3)ccnc2cc1OCC1(N)CC1.

What is the InChIKey of 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide?

The InChIKey is FPHFYADRVDBUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H30ClF3N4O3.C32H26ClF3N4O3.C31H31N5O4.C29H27N5O4/c1-42(2)33(12-13-33)19-45-31-18-29-25(17-30(31)44-3)28(11-14-39-29)40-21-7-9-23-20(15-21)5-4-6-24(23)32(43)41-22-8-10-27(35)26(16-22)34(36,37)38;1-42-28-15-23-26(9-12-38-27(23)16-29(28)43-17-31(37)10-11-31)39-19-5-7-21-18(13-19)3-2-4-22(21)30(41)40-20-6-8-25(33)24(14-20)32(34,35)36;1-19-14-29(35-40-19)34-30(37)23-7-5-6-20-15-21(8-9-22(20)23)33-25-10-13-32-26-17-28(27(38-4)16-24(25)26)39-18-31(11-12-31)36(2)3;1-17-12-27(34-38-17)33-28(35)21-5-3-4-18-13-19(6-7-20(18)21)32-23-8-11-31-24-15-26(25(36-2)14-22(23)24)37-16-29(30)9-10-29/h4-11,14-18H,12-13,19H2,1-3H3,(H,39,40)(H,41,43);2-9,12-16H,10-11,17,37H2,1H3,(H,38,39)(H,40,41);5-10,13-17H,11-12,18H2,1-4H3,(H,32,33)(H,34,35,37);3-8,11-15H,9-10,16,30H2,1-2H3,(H,31,32)(H,33,34,35).

What are the key properties of 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide?

6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide has a molecular weight of 2289.30 g/mol, XLogP of 28.19, 34 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]naphthalene-1-carboxamide;6-[[7-[(1-aminocyclopropyl)methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide;N-[4-chloro-3-(trifluoromethyl)phenyl]-6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]naphthalene-1-carboxamide;6-[[7-[[1-(dimethylamino)cyclopropyl]methoxy]-6-methoxyquinolin-4-yl]amino]-N-(5-methyl-1,2-oxazol-3-yl)naphthalene-1-carboxamide is sourced from PubChem (CID 158101315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).