C214H169ClF7N31O6 — CID 159598464
3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]-5-methylphenol;3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]phenol;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1,5-naphthyridin-4-amine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-methoxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(2-methylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-yloxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-[3-(2,2,2-trifluoroethoxy)phenyl]-3-pyridinyl]quinolin-4-amine;6-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]quinolin-4-amine (PubChem CID 159598464) has the molecular formula C214H169ClF7N31O6 and a molecular weight of 3439.36 g/mol. Its IUPAC name is 3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]-5-methylphenol;3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]phenol;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1,5-naphthyridin-4-amine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-methoxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(2-methylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-yloxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-[3-(2,2,2-trifluoroethoxy)phenyl]-3-pyridinyl]quinolin-4-amine;6-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]quinolin-4-amine.
| Compound Name | 3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]-5-methylphenol;3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]phenol;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1,5-naphthyridin-4-amine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-methoxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(2-methylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-yloxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-[3-(2,2,2-trifluoroethoxy)phenyl]-3-pyridinyl]quinolin-4-amine;6-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]quinolin-4-amine |
|---|---|
| PubChem CID | 159598464 |
| Molecular Formula | C214H169ClF7N31O6 |
| Molecular Weight | 3439.36 g/mol |
| Exact Mass | 3436.34 |
| IUPAC Name | 3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]-5-methylphenol;3-[3-(4-aminoquinolin-6-yl)-2-pyridinyl]phenol;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1,5-naphthyridin-4-amine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-methoxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(2-methylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-yloxyphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]quinolin-4-amine;6-[2-[3-(2,2,2-trifluoroethoxy)phenyl]-3-pyridinyl]quinolin-4-amine;6-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]quinolin-4-amine |
| SMILES | CC(C)Oc1cccc(-c2ncccc2-c2ccc3nccc(N)c3c2)c1.CC(C)c1cccc(-c2ncccc2-c2ccc3nccc(N)c3c2)c1.COc1cccc(-c2ncccc2-c2ccc3nccc(N)c3c2)c1.Cc1cc(O)cc(-c2ncccc2-c2ccc3nccc(N)c3c2)c1.Cc1ccccc1-c1ncccc1-c1ccc2nccc(N)c2c1.Nc1ccnc2ccc(-c3cccnc3-c3ccc(F)c(Cl)c3)nc12.Nc1ccnc2ccc(-c3cccnc3-c3cccc(C4CC4)c3)cc12.Nc1ccnc2ccc(-c3cccnc3-c3cccc(O)c3)cc12.Nc1ccnc2ccc(-c3cccnc3-c3cccc(OC(F)(F)F)c3)cc12.Nc1ccnc2ccc(-c3cccnc3-c3cccc(OCC(F)(F)F)c3)cc12 |
| InChI | InChI=1S/C23H21N3O.C23H19N3.C23H21N3.C22H16F3N3O.C21H14F3N3O.2C21H17N3O.C21H17N3.C20H15N3O.C19H12ClFN4/c1-15(2)27-18-6-3-5-17(13-18)23-19(7-4-11-26-23)16-8-9-22-20(14-16)21(24)10-12-25-22;24-21-10-12-25-22-9-8-17(14-20(21)22)19-5-2-11-26-23(19)18-4-1-3-16(13-18)15-6-7-15;1-15(2)16-5-3-6-18(13-16)23-19(7-4-11-26-23)17-8-9-22-20(14-17)21(24)10-12-25-22;23-22(24,25)13-29-16-4-1-3-15(11-16)21-17(5-2-9-28-21)14-6-7-20-18(12-14)19(26)8-10-27-20;22-21(23,24)28-15-4-1-3-14(11-15)20-16(5-2-9-27-20)13-6-7-19-17(12-13)18(25)8-10-26-19;1-25-16-5-2-4-15(12-16)21-17(6-3-10-24-21)14-7-8-20-18(13-14)19(22)9-11-23-20;1-13-9-15(11-16(25)10-13)21-17(3-2-7-24-21)14-4-5-20-18(12-14)19(22)6-8-23-20;1-14-5-2-3-6-16(14)21-17(7-4-11-24-21)15-8-9-20-18(13-15)19(22)10-12-23-20;21-18-8-10-22-19-7-6-13(12-17(18)19)16-5-2-9-23-20(16)14-3-1-4-15(24)11-14;20-13-10-11(3-4-14(13)21)18-12(2-1-8-24-18)16-5-6-17-19(25-16)15(22)7-9-23-17/h3-15H,1-2H3,(H2,24,25);1-5,8-15H,6-7H2,(H2,24,25);3-15H,1-2H3,(H2,24,25);1-12H,13H2,(H2,26,27);1-12H,(H2,25,26);2-13H,1H3,(H2,22,23);2-12,25H,1H3,(H2,22,23);2-13H,1H3,(H2,22,23);1-12,24H,(H2,21,22);1-10H,(H2,22,23) |
| InChIKey | MLDQAOPXJFAQEB-UHFFFAOYSA-N |
| XLogP | 50.31 |
| TPSA | 608.27 Ų |
| H-Bond Donors | 12 |
| H-Bond Acceptors | 37 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 259 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3439.36 |
| LogP ≤ 5 | 50.31 |
| H-Bond Donors ≤ 5 | 12 |
| H-Bond Acceptors ≤ 10 | 37 |