C92H87N25O7 — CID 159550905
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide (PubChem CID 159550905) has the molecular formula C92H87N25O7 and a molecular weight of 1654.88 g/mol. Its IUPAC name is 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-morpholin-4-yl-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-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide |
|---|---|
| PubChem CID | 159550905 |
| Molecular Formula | C92H87N25O7 |
| Molecular Weight | 1654.88 g/mol |
| Exact Mass | 1653.72 |
| IUPAC Name | 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-morpholin-4-yl-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(CN5CCCC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(N5CCOCC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(NC(=O)C5CC5)c4)cc23)cn1.Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cncc(NC(=O)N(C)C)c4)cc23)cn1 |
| InChI | InChI=1S/C24H24N6O.C23H20N6O2.C23H22N6O2.C22H21N7O2/c1-16-4-6-20(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;1-15-2-4-18(13-25-15)26-23(30)22-20-11-16(3-5-21(20)27-28-22)17-10-19(14-24-12-17)29-6-8-31-9-7-29;1-13-4-6-16(12-24-13)25-21(30)20-18-9-14(5-7-19(18)27-28-20)15-8-17(11-23-10-15)26-22(31)29(2)3/h4-7,10-14H,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);2-5,10-14H,6-9H2,1H3,(H,26,30)(H,27,28);4-12H,1-3H3,(H,25,30)(H,26,31)(H,27,28) |
| InChIKey | MFJLPWGGDNTLFK-UHFFFAOYSA-N |
| XLogP | 15.20 |
| TPSA | 411.39 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 21 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 124 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1654.88 |
| LogP ≤ 5 | 15.20 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 21 |