About N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide
N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide (PubChem CID 159276444) has the molecular formula C146H181N35O20S5
and a molecular weight of 2906.61 g/mol. Its IUPAC name is N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide.
Frequently Asked Questions
What is the IUPAC name of N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide?
The IUPAC name of N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide (CID 159276444) is N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide.
What is the SMILES notation for N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide?
The canonical SMILES for N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide is CCC(C)NS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCOCC3)cc2OC)nc2c1C1(CC1)CN2.CCCNS(=O)(=O)c1ccccc1Nc1nc(Nc2ccc(N3CCOCC3)cc2OC)nc2c1C1(CC1)CN2.COc1cc(N2CCOCC2)ccc1Nc1nc2c(c(Nc3ccccc3S(=O)(=O)NC3CC3)n1)C1(CC1)CN2.COc1cc(N2CCOCC2)ccc1Nc1nc2c(c(Nc3ccccc3S(=O)(=O)NC3CCCC3)n1)C1(CC1)CN2.COc1cc(N2CCOCC2)ccc1Nc1nc2c(c(Nc3ccccc3S(=O)(=O)NC3CCCCC3)n1)C1(CC1)CN2.
What is the InChIKey of N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide?
The InChIKey is KYJCDDPIPGBVBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H39N7O4S.C30H37N7O4S.C29H37N7O4S.C28H33N7O4S.C28H35N7O4S/c1-41-25-19-22(38-15-17-42-18-16-38)11-12-23(25)34-30-35-28-27(31(13-14-31)20-32-28)29(36-30)33-24-9-5-6-10-26(24)43(39,40)37-21-7-3-2-4-8-21;1-40-24-18-21(37-14-16-41-17-15-37)10-11-22(24)33-29-34-27-26(30(12-13-30)19-31-27)28(35-29)32-23-8-4-5-9-25(23)42(38,39)36-20-6-2-3-7-20;1-4-19(2)35-41(37,38)24-8-6-5-7-22(24)31-27-25-26(30-18-29(25)11-12-29)33-28(34-27)32-21-10-9-20(17-23(21)39-3)36-13-15-40-16-14-36;1-38-22-16-19(35-12-14-39-15-13-35)8-9-20(22)31-27-32-25-24(28(10-11-28)17-29-25)26(33-27)30-21-4-2-3-5-23(21)40(36,37)34-18-6-7-18;1-3-12-30-40(36,37)23-7-5-4-6-21(23)31-26-24-25(29-18-28(24)10-11-28)33-27(34-26)32-20-9-8-19(17-22(20)38-2)35-13-15-39-16-14-35/h5-6,9-12,19,21,37H,2-4,7-8,13-18,20H2,1H3,(H3,32,33,34,35,36);4-5,8-11,18,20,36H,2-3,6-7,12-17,19H2,1H3,(H3,31,32,33,34,35);5-10,17,19,35H,4,11-16,18H2,1-3H3,(H3,30,31,32,33,34);2-5,8-9,16,18,34H,6-7,10-15,17H2,1H3,(H3,29,30,31,32,33);4-9,17,30H,3,10-16,18H2,1-2H3,(H3,29,31,32,33,34).
What are the key properties of N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide?
N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide has a molecular weight of 2906.61 g/mol, XLogP of 21.37, 47 rotatable bonds, 20 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclohexyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopentyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;N-cyclopropyl-2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]benzenesulfonamide;2-[[2-(2-methoxy-4-morpholin-4-ylanilino)spiro[6,7-dihydropyrrolo[2,3-d]pyrimidine-5,1'-cyclopropane]-4-yl]amino]-N-propylbenzenesulfonamide is sourced from PubChem (CID 159276444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).