C72H73N19O10 — CID 158022095
6-(furan-2-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;6-(1H-indazol-5-ylmethyl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide (PubChem CID 158022095) has the molecular formula C72H73N19O10 and a molecular weight of 1364.50 g/mol. Its IUPAC name is 6-(furan-2-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;6-(1H-indazol-5-ylmethyl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide.
| Compound Name | 6-(furan-2-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;6-(1H-indazol-5-ylmethyl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide |
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| PubChem CID | 158022095 |
| Molecular Formula | C72H73N19O10 |
| Molecular Weight | 1364.50 g/mol |
| Exact Mass | 1363.58 |
| IUPAC Name | 6-(furan-2-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;6-(1H-indazol-5-ylmethyl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(1H-pyrazol-4-yl)pyridine-2-carboxamide |
| SMILES | COCCOCCn1cc(NC(=O)c2cccc(-c3ccco3)n2)c(-c2ccccn2)n1.COCCOCCn1cc(NC(=O)c2cccc(-c3cn[nH]c3)n2)c(-c2ccccn2)n1.COCCOCCn1cc(NC(=O)c2cccc(Cc3ccc4[nH]ncc4c3)n2)c(-c2ccccn2)n1 |
| InChI | InChI=1S/C27H27N7O3.C23H23N5O4.C22H23N7O3/c1-36-13-14-37-12-11-34-18-25(26(33-34)23-6-2-3-10-28-23)31-27(35)24-7-4-5-21(30-24)16-19-8-9-22-20(15-19)17-29-32-22;1-30-14-15-31-13-11-28-16-20(22(27-28)18-6-2-3-10-24-18)26-23(29)19-8-4-7-17(25-19)21-9-5-12-32-21;1-31-11-12-32-10-9-29-15-20(21(28-29)18-5-2-3-8-23-18)27-22(30)19-7-4-6-17(26-19)16-13-24-25-14-16/h2-10,15,17-18H,11-14,16H2,1H3,(H,29,32)(H,31,35);2-10,12,16H,11,13-15H2,1H3,(H,26,29);2-8,13-15H,9-12H2,1H3,(H,24,25)(H,27,30) |
| InChIKey | FGEHZFMSMBIDJL-UHFFFAOYSA-N |
| XLogP | 9.88 |
| TPSA | 343.98 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 101 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1364.50 |
| LogP ≤ 5 | 9.88 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 24 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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