About 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine
4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine (PubChem CID 157378522) has the molecular formula C199H190ClFN26O14
and a molecular weight of 3224.33 g/mol. Its IUPAC name is 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine.
Frequently Asked Questions
What is the IUPAC name of 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine?
The IUPAC name of 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine (CID 157378522) is 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine.
What is the SMILES notation for 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine?
The canonical SMILES for 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine is COc1c(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2C)cnc2c(-c3ccc(C#N)cc3)cccc12.COc1c(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2Cl)cnc2c(-c3ccc(C#N)cc3)cccc12.COc1c(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cn2)cnc2c(-c3ccc(C#N)cc3)cccc12.COc1c(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)cnc2c(-c3ccnn3C)cccc12.COc1c(-c2cnc(N3C[C@@H](C)O[C@@H](C)C3)cc2C)cnc2c(-c3ccc(C#N)cc3)cccc12.[C-]#[N+]c1ccc(-c2cccc3c(OC)c(-c4ccc(N5C[C@@H](C)O[C@@H](C)C5)cc4F)cnc23)cc1.[C-]#[N+]c1ccc(-c2cccc3c(OC)c(-c4ccc(N5C[C@@H](C)O[C@@H](C)C5)nc4C)cnc23)cc1.
What is the InChIKey of 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine?
The InChIKey is BKPGPPIYVPYDLH-PPFXDKGLSA-N. The full InChI is InChI=1S/C30H29N3O2.C29H26ClN3O2.C29H26FN3O2.2C29H28N4O2.C28H26N4O2.C25H27N5O2/c1-19-14-24(33-17-20(2)35-21(3)18-33)12-13-25(19)28-16-32-29-26(6-5-7-27(29)30(28)34-4)23-10-8-22(15-31)9-11-23;1-18-16-33(17-19(2)35-18)22-11-12-24(27(30)13-22)26-15-32-28-23(5-4-6-25(28)29(26)34-3)21-9-7-20(14-31)8-10-21;1-18-16-33(17-19(2)35-18)22-12-13-24(27(30)14-22)26-15-32-28-23(6-5-7-25(28)29(26)34-4)20-8-10-21(31-3)11-9-20;1-18-16-33(17-19(2)35-18)27-14-13-23(20(3)32-27)26-15-31-28-24(7-6-8-25(28)29(26)34-5)21-9-11-22(30-4)12-10-21;1-18-12-27(33-16-19(2)35-20(3)17-33)31-14-25(18)26-15-32-28-23(6-5-7-24(28)29(26)34-4)22-10-8-21(13-30)9-11-22;1-18-16-32(17-19(2)34-18)22-11-12-26(30-14-22)25-15-31-27-23(5-4-6-24(27)28(25)33-3)21-9-7-20(13-29)8-10-21;1-16-14-30(15-17(2)32-16)23-9-8-18(12-26-23)21-13-27-24-19(22-10-11-28-29(22)3)6-5-7-20(24)25(21)31-4/h5-14,16,20-21H,17-18H2,1-4H3;4-13,15,18-19H,16-17H2,1-3H3;5-15,18-19H,16-17H2,1-2,4H3;6-15,18-19H,16-17H2,1-3,5H3;5-12,14-15,19-20H,16-17H2,1-4H3;4-12,14-15,18-19H,16-17H2,1-3H3;5-13,16-17H,14-15H2,1-4H3/t20-,21+;3*18-,19+;19-,20+;18-,19+;16-,17+.
What are the key properties of 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine?
4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine has a molecular weight of 3224.33 g/mol, XLogP of 41.96, 28 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[2-chloro-4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-methylphenyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-methyl-3-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;4-[3-[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-4-methoxyquinolin-8-yl]benzonitrile;(2S,6R)-4-[3-fluoro-4-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]phenyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-6-methyl-2-pyridinyl]-2,6-dimethylmorpholine;(2S,6R)-4-[5-[4-methoxy-8-(2-methylpyrazol-3-yl)quinolin-3-yl]-2-pyridinyl]-2,6-dimethylmorpholine is sourced from PubChem (CID 157378522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).