About (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide
(3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide (PubChem CID 163442063) has the molecular formula C150H153F7N12O9
and a molecular weight of 2400.93 g/mol. Its IUPAC name is (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide.
Frequently Asked Questions
What is the IUPAC name of (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide?
The IUPAC name of (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide (CID 163442063) is (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide.
What is the SMILES notation for (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide?
The canonical SMILES for (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide is COc1ccc2c(c1)C[C@H](C(=O)Nc1ccc(C)c(C)c1)[C@H](c1ccc(NC3CCCC3)cc1)N2C(=O)c1c(C)cccc1F.Cc1ccc(NC(=O)[C@H]2Cc3cc(F)c(F)cc3N(C(=O)c3c(C)cccc3F)C2c2ccc(NC3CCCC3)cc2)cc1C.Cc1ccc(NC(=O)[C@H]2Cc3cc(F)ccc3N(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(NC3CCCC3)cc2)cc1C.Cc1ccc2c(c1)C[C@H](C(=O)Nc1ccc(C)c(C)c1)[C@H](c1ccc(NC3CCCC3)cc1)N2C(=O)c1c(C)cccc1F.
What is the InChIKey of (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide?
The InChIKey is AZJNQRZHRULNHC-BXVXXNTOSA-N. The full InChI is InChI=1S/C38H40FN3O3.C38H40FN3O2.C37H36F3N3O2.C37H37F2N3O2/c1-23-12-15-30(20-25(23)3)41-37(43)32-22-27-21-31(45-4)18-19-34(27)42(38(44)35-24(2)8-7-11-33(35)39)36(32)26-13-16-29(17-14-26)40-28-9-5-6-10-28;1-23-12-19-34-28(20-23)22-32(37(43)41-31-16-13-24(2)26(4)21-31)36(42(34)38(44)35-25(3)8-7-11-33(35)39)27-14-17-30(18-15-27)40-29-9-5-6-10-29;1-21-11-14-28(17-23(21)3)42-36(44)29-18-25-19-31(39)32(40)20-33(25)43(37(45)34-22(2)7-6-10-30(34)38)35(29)24-12-15-27(16-13-24)41-26-8-4-5-9-26;1-22-11-15-30(19-24(22)3)41-36(43)31-21-26-20-27(38)14-18-33(26)42(37(44)34-23(2)7-6-10-32(34)39)35(31)25-12-16-29(17-13-25)40-28-8-4-5-9-28/h7-8,11-21,28,32,36,40H,5-6,9-10,22H2,1-4H3,(H,41,43);7-8,11-21,29,32,36,40H,5-6,9-10,22H2,1-4H3,(H,41,43);6-7,10-17,19-20,26,29,35,41H,4-5,8-9,18H2,1-3H3,(H,42,44);6-7,10-20,28,31,35,40H,4-5,8-9,21H2,1-3H3,(H,41,43)/t2*32-,36-;29-,35?;31-,35-/m0000/s1.
What are the key properties of (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide?
(3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide has a molecular weight of 2400.93 g/mol, XLogP of 33.95, 25 rotatable bonds, 8 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6,7-difluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-6-fluoro-1-(2-fluoro-6-methylbenzoyl)-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methoxy-3,4-dihydro-2H-quinoline-3-carboxamide;(2R,3S)-2-[4-(cyclopentylamino)phenyl]-N-(3,4-dimethylphenyl)-1-(2-fluoro-6-methylbenzoyl)-6-methyl-3,4-dihydro-2H-quinoline-3-carboxamide is sourced from PubChem (CID 163442063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).