C274H243F17N72O17 — CID 159725319
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(4-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-oxo-1H-pyridin-3-yl)-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 159725319) has the molecular formula C274H243F17N72O17 and a molecular weight of 5139.41 g/mol. Its IUPAC name is 5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(4-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-oxo-1H-pyridin-3-yl)-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide.
| Compound Name | 5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(4-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-oxo-1H-pyridin-3-yl)-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide |
|---|---|
| PubChem CID | 159725319 |
| Molecular Formula | C274H243F17N72O17 |
| Molecular Weight | 5139.41 g/mol |
| Exact Mass | 5136.01 |
| IUPAC Name | 5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(4-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-oxo-1H-pyridin-3-yl)-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-(4-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(5-fluoro-3-pyridinyl)-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide |
| SMILES | O=C(Nc1ccc(=O)[nH]c1)c1n[nH]c2ccc(-c3cncc(CN4CCC(F)(F)C4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(CN4CCC(F)(F)C4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(CN4CCC(F)(F)CC4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(CN4CCC4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(CN4CCCC4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(CN4CCOCC4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(N4CCCC4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(N4CCCCC4)c3)cc12.O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(N4CCOCC4)c3)cc12.O=C(Nc1cnccc1F)c1n[nH]c2ccc(-c3cncc(CN4CCC(O)CC4)c3)cc12.O=C(Nc1cnccc1F)c1n[nH]c2ccc(-c3cncc(CN4CCC4)c3)cc12.O=C(Nc1cnccc1F)c1n[nH]c2ccc(-c3cncc(CN4CCOCC4)c3)cc12 |
| InChI | InChI=1S/C24H21F3N6O.C24H23FN6O2.C23H19F3N6O.C23H20F2N6O2.2C23H21FN6O2.2C23H21FN6O.C22H19FN6O2.3C22H19FN6O/c25-18-9-19(13-29-12-18)30-23(34)22-20-8-16(1-2-21(20)31-32-22)17-7-15(10-28-11-17)14-33-5-3-24(26,27)4-6-33;25-20-3-6-26-13-22(20)28-24(33)23-19-10-16(1-2-21(19)29-30-23)17-9-15(11-27-12-17)14-31-7-4-18(32)5-8-31;24-17-7-18(11-28-10-17)29-22(33)21-19-6-15(1-2-20(19)30-31-21)16-5-14(8-27-9-16)12-32-4-3-23(25,26)13-32;24-23(25)5-6-31(13-23)12-14-7-16(10-26-9-14)15-1-3-19-18(8-15)21(30-29-19)22(33)28-17-2-4-20(32)27-11-17;24-18-9-19(13-26-12-18)27-23(31)22-20-8-16(1-2-21(20)28-29-22)17-7-15(10-25-11-17)14-30-3-5-32-6-4-30;24-19-3-4-25-13-21(19)27-23(31)22-18-10-16(1-2-20(18)28-29-22)17-9-15(11-26-12-17)14-30-5-7-32-8-6-30;24-18-9-19(13-26-12-18)27-23(31)22-20-8-16(3-4-21(20)28-29-22)17-7-15(10-25-11-17)14-30-5-1-2-6-30;24-17-10-18(13-26-12-17)27-23(31)22-20-9-15(4-5-21(20)28-29-22)16-8-19(14-25-11-16)30-6-2-1-3-7-30;23-16-9-17(12-25-11-16)26-22(30)21-19-8-14(1-2-20(19)27-28-21)15-7-18(13-24-10-15)29-3-5-31-6-4-29;23-18-4-5-24-12-20(18)26-22(30)21-17-9-15(2-3-19(17)27-28-21)16-8-14(10-25-11-16)13-29-6-1-7-29;23-17-8-18(12-25-11-17)26-22(30)21-19-7-15(2-3-20(19)27-28-21)16-6-14(9-24-10-16)13-29-4-1-5-29;23-16-9-17(12-25-11-16)26-22(30)21-19-8-14(3-4-20(19)27-28-21)15-7-18(13-24-10-15)29-5-1-2-6-29/h1-2,7-13H,3-6,14H2,(H,30,34)(H,31,32);1-3,6,9-13,18,32H,4-5,7-8,14H2,(H,28,33)(H,29,30);1-2,5-11H,3-4,12-13H2,(H,29,33)(H,30,31);1-4,7-11H,5-6,12-13H2,(H,27,32)(H,28,33)(H,29,30);1-2,7-13H,3-6,14H2,(H,27,31)(H,28,29);1-4,9-13H,5-8,14H2,(H,27,31)(H,28,29);3-4,7-13H,1-2,5-6,14H2,(H,27,31)(H,28,29);4-5,8-14H,1-3,6-7H2,(H,27,31)(H,28,29);1-2,7-13H,3-6H2,(H,26,30)(H,27,28);2-5,8-12H,1,6-7,13H2,(H,26,30)(H,27,28);2-3,6-12H,1,4-5,13H2,(H,26,30)(H,27,28);3-4,7-13H,1-2,5-6H2,(H,26,30)(H,27,28) |
| InChIKey | NAOCPRXDAYIOPD-UHFFFAOYSA-N |
| XLogP | 45.06 |
| TPSA | 1109.49 Ų |
| H-Bond Donors | 26 |
| H-Bond Acceptors | 64 |
| Rotatable Bonds | 57 |
| Heavy Atoms | 380 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5139.41 |
| LogP ≤ 5 | 45.06 |
| H-Bond Donors ≤ 5 | 26 |
| H-Bond Acceptors ≤ 10 | 64 |