About 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide
5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide (PubChem CID 162050848) has the molecular formula C148H145Br2F15N42O11
and a molecular weight of 3132.85 g/mol. Its IUPAC name is 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide.
Frequently Asked Questions
What is the IUPAC name of 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide?
The IUPAC name of 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide (CID 162050848) is 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide.
What is the SMILES notation for 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide?
The canonical SMILES for 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide is Brc1cnc(Nc2cnc3[nH]ccc3c2)nc1NC1CC1.CC(=O)Nc1ccc(Nc2nc(Nc3ccc4c(c3)CCC(=O)N4)ncc2C(F)(F)F)cc1.CCc1cc(Nc2ncc(Br)c(NC3CC3)n2)cc(OC)c1OC.CCc1cc(Nc2ncc(C(F)(F)F)c(NC3CC3)n2)cc(OC)c1OC.COc1cccc(Nc2nc(Nc3ccc4c(c3)CCC(=O)N4)ncc2C(F)(F)F)c1.Cc1cnc(Nc2ccc3c(c2)CCC(=O)N3)nc1NC1CC1.O=C1CCc2cc(Nc3ncc(C(F)(F)F)c(NC4CCC4)n3)ccc2N1.O=C1CCc2cc(Nc3ncc(C(F)(F)F)c(Nc4ccc5[nH]ncc5c4)n3)ccc2N1.
What is the InChIKey of 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide?
The InChIKey is YYNJHQBZYUDGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19F3N6O2.C21H16F3N7O.C21H18F3N5O2.C18H18F3N5O.C18H21F3N4O2.C17H21BrN4O2.C17H19N5O.C14H13BrN6/c1-12(32)27-14-3-5-15(6-4-14)28-20-17(22(23,24)25)11-26-21(31-20)29-16-7-8-18-13(10-16)2-9-19(33)30-18;22-21(23,24)15-10-25-20(28-14-2-4-16-11(7-14)1-6-18(32)29-16)30-19(15)27-13-3-5-17-12(8-13)9-26-31-17;1-31-15-4-2-3-13(10-15)26-19-16(21(22,23)24)11-25-20(29-19)27-14-6-7-17-12(9-14)5-8-18(30)28-17;19-18(20,21)13-9-22-17(26-16(13)23-11-2-1-3-11)24-12-5-6-14-10(8-12)4-7-15(27)25-14;1-4-10-7-12(8-14(26-2)15(10)27-3)24-17-22-9-13(18(19,20)21)16(25-17)23-11-5-6-11;1-4-10-7-12(8-14(23-2)15(10)24-3)21-17-19-9-13(18)16(22-17)20-11-5-6-11;1-10-9-18-17(22-16(10)19-12-3-4-12)20-13-5-6-14-11(8-13)2-7-15(23)21-14;15-11-7-18-14(21-13(11)19-9-1-2-9)20-10-5-8-3-4-16-12(8)17-6-10/h3-8,10-11H,2,9H2,1H3,(H,27,32)(H,30,33)(H2,26,28,29,31);2-5,7-10H,1,6H2,(H,26,31)(H,29,32)(H2,25,27,28,30);2-4,6-7,9-11H,5,8H2,1H3,(H,28,30)(H2,25,26,27,29);5-6,8-9,11H,1-4,7H2,(H,25,27)(H2,22,23,24,26);7-9,11H,4-6H2,1-3H3,(H2,22,23,24,25);7-9,11H,4-6H2,1-3H3,(H2,19,20,21,22);5-6,8-9,12H,2-4,7H2,1H3,(H,21,23)(H2,18,19,20,22);3-7,9H,1-2H2,(H,16,17)(H2,18,19,20,21).
What are the key properties of 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide?
5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide has a molecular weight of 3132.85 g/mol, XLogP of 33.48, 40 rotatable bonds, 24 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)pyrimidine-2,4-diamine;5-bromo-4-N-cyclopropyl-2-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidine-2,4-diamine;6-[[4-(cyclobutylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(cyclopropylamino)-5-methylpyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;4-N-cyclopropyl-2-N-(3-ethyl-4,5-dimethoxyphenyl)-5-(trifluoromethyl)pyrimidine-2,4-diamine;6-[[4-(1H-indazol-5-ylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;6-[[4-(3-methoxyanilino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one;N-[4-[[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]phenyl]acetamide is sourced from PubChem (CID 162050848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).