C119H109N29O8 — CID 157205182
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide (PubChem CID 157205182) has the molecular formula C119H109N29O8 and a molecular weight of 2073.38 g/mol. Its IUPAC name is 5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide.
| Compound Name | 5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide |
|---|---|
| PubChem CID | 157205182 |
| Molecular Formula | C119H109N29O8 |
| Molecular Weight | 2073.38 g/mol |
| Exact Mass | 2071.90 |
| IUPAC Name | 5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide |
| SMILES | Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(CN5CCC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(CN5CCCC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(CN5CCOCC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(NC(=O)C5CC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(Oc5ccccc5)c4)cc23)cn1 |
| InChI | InChI=1S/C25H19N5O2.C24H24N6O2.C24H24N6O.C23H20N6O2.C23H22N6O/c1-16-7-9-19(14-27-16)28-25(31)24-22-12-17(8-10-23(22)29-30-24)18-11-21(15-26-13-18)32-20-5-3-2-4-6-20;1-16-2-4-20(14-26-16)27-24(31)23-21-11-18(3-5-22(21)28-29-23)19-10-17(12-25-13-19)15-30-6-8-32-9-7-30;1-16-4-6-20(14-26-16)27-24(31)23-21-11-18(5-7-22(21)28-29-23)19-10-17(12-25-13-19)15-30-8-2-3-9-30;1-13-2-6-17(12-25-13)26-23(31)21-19-9-15(5-7-20(19)28-29-21)16-8-18(11-24-10-16)27-22(30)14-3-4-14;1-15-3-5-19(13-25-15)26-23(30)22-20-10-17(4-6-21(20)27-28-22)18-9-16(11-24-12-18)14-29-7-2-8-29/h2-15H,1H3,(H,28,31)(H,29,30);2-5,10-14H,6-9,15H2,1H3,(H,27,31)(H,28,29);4-7,10-14H,2-3,8-9,15H2,1H3,(H,27,31)(H,28,29);2,5-12,14H,3-4H2,1H3,(H,26,31)(H,27,30)(H,28,29);3-6,9-13H,2,7-8,14H2,1H3,(H,26,30)(H,27,28) |
| InChIKey | ARGQCHKTLPHDCM-UHFFFAOYSA-N |
| XLogP | 20.68 |
| TPSA | 475.08 Ų |
| H-Bond Donors | 11 |
| H-Bond Acceptors | 26 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 156 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2073.38 |
| LogP ≤ 5 | 20.68 |
| H-Bond Donors ≤ 5 | 11 |
| H-Bond Acceptors ≤ 10 | 26 |