C154H207F3N34O16 — CID 158063088
ethoxyethane;8-[4-[[5-(2-methoxyethoxy)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(4-methoxy-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;6-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine;8-[4-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(6-methyl-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(2,2,2-trifluoro-1-methoxyethyl)pyridin-2-amine (PubChem CID 158063088) has the molecular formula C154H207F3N34O16 and a molecular weight of 2847.57 g/mol. Its IUPAC name is ethoxyethane;8-[4-[[5-(2-methoxyethoxy)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(4-methoxy-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;6-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine;8-[4-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(6-methyl-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(2,2,2-trifluoro-1-methoxyethyl)pyridin-2-amine.
| Compound Name | ethoxyethane;8-[4-[[5-(2-methoxyethoxy)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(4-methoxy-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;6-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine;8-[4-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(6-methyl-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(2,2,2-trifluoro-1-methoxyethyl)pyridin-2-amine |
|---|---|
| PubChem CID | 158063088 |
| Molecular Formula | C154H207F3N34O16 |
| Molecular Weight | 2847.57 g/mol |
| Exact Mass | 2845.64 |
| IUPAC Name | ethoxyethane;8-[4-[[5-(2-methoxyethoxy)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(4-methoxy-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;6-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-amine;8-[4-[[5-(4-methylpiperazin-1-yl)-2-pyridinyl]amino]cyclohexyl]oxyquinoxalin-6-amine;8-[4-[(6-methyl-2-pyridinyl)amino]cyclohexyl]oxyquinoxalin-6-amine;N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-5-(2,2,2-trifluoro-1-methoxyethyl)pyridin-2-amine |
| SMILES | CCOCC.CCOCC.CCOCC.CCOCC.CN1CCN(c2ccc(NC3CCC(Oc4cc(N)cc5nccnc45)CC3)nc2)CC1.CN1CCc2nc(NC3CCC(Oc4cc(N5CCOCC5)cc5nccnc45)CC3)ncc2C1.COC(c1ccc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)nc1)C(F)(F)F.COCCOc1ccc(NC2CCC(Oc3cc(N)cc4nccnc34)CC2)nc1.COc1ccnc(NC2CCC(Oc3cc(N)cc4nccnc34)CC2)c1.Cc1cccc(NC2CCC(Oc3cc(N)cc4nccnc34)CC2)n1 |
| InChI | InChI=1S/C26H30F3N5O3.C26H33N7O2.C24H31N7O.C22H27N5O3.C20H23N5O2.C20H23N5O.4C4H10O/c1-35-25(26(27,28)29)17-2-7-23(32-16-17)33-18-3-5-20(6-4-18)37-22-15-19(34-10-12-36-13-11-34)14-21-24(22)31-9-8-30-21;1-32-9-6-22-18(17-32)16-29-26(31-22)30-19-2-4-21(5-3-19)35-24-15-20(33-10-12-34-13-11-33)14-23-25(24)28-8-7-27-23;1-30-10-12-31(13-11-30)19-4-7-23(28-16-19)29-18-2-5-20(6-3-18)32-22-15-17(25)14-21-24(22)27-9-8-26-21;1-28-10-11-29-18-6-7-21(26-14-18)27-16-2-4-17(5-3-16)30-20-13-15(23)12-19-22(20)25-9-8-24-19;1-26-16-6-7-23-19(12-16)25-14-2-4-15(5-3-14)27-18-11-13(21)10-17-20(18)24-9-8-22-17;1-13-3-2-4-19(24-13)25-15-5-7-16(8-6-15)26-18-12-14(21)11-17-20(18)23-10-9-22-17;4*1-3-5-4-2/h2,7-9,14-16,18,20,25H,3-6,10-13H2,1H3,(H,32,33);7-8,14-16,19,21H,2-6,9-13,17H2,1H3,(H,29,30,31);4,7-9,14-16,18,20H,2-3,5-6,10-13,25H2,1H3,(H,28,29);6-9,12-14,16-17H,2-5,10-11,23H2,1H3,(H,26,27);6-12,14-15H,2-5,21H2,1H3,(H,23,25);2-4,9-12,15-16H,5-8,21H2,1H3,(H,24,25);4*3-4H2,1-2H3 |
| InChIKey | FKWTWYXLXDHYPH-UHFFFAOYSA-N |
| XLogP | 25.86 |
| TPSA | 585.05 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 50 |
| Rotatable Bonds | 42 |
| Heavy Atoms | 207 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2847.57 |
| LogP ≤ 5 | 25.86 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 50 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'} |
|---|