C102H118N24O14 — CID 159015223
3-amino-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide;3-hydroxy-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide (PubChem CID 159015223) has the molecular formula C102H118N24O14 and a molecular weight of 1904.22 g/mol. Its IUPAC name is 3-amino-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide;3-hydroxy-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide.
| Compound Name | 3-amino-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide;3-hydroxy-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide |
|---|---|
| PubChem CID | 159015223 |
| Molecular Formula | C102H118N24O14 |
| Molecular Weight | 1904.22 g/mol |
| Exact Mass | 1902.93 |
| IUPAC Name | 3-amino-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide;3-hydroxy-N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-methyloxan-4-yl)oxyindazol-6-yl]pyridine-2-carboxamide;N-[1-methyl-3-(2-piperidin-1-ylethoxy)indazol-6-yl]pyridine-2-carboxamide |
| SMILES | CC1CC(Oc2nn(C)c3cc(NC(=O)c4ccccn4)ccc23)CCO1.CC1CC(Oc2nn(C)c3cc(NC(=O)c4ncccc4N)ccc23)CCO1.CC1CC(Oc2nn(C)c3cc(NC(=O)c4ncccc4O)ccc23)CCO1.Cn1nc(OCCN2CCCCC2)c2ccc(NC(=O)c3ccccn3)cc21.Cn1nc(OCCN2CCCCC2)c2ccc(NC(=O)c3ncccc3N)cc21 |
| InChI | InChI=1S/C21H26N6O2.C21H25N5O2.C20H23N5O3.C20H22N4O4.C20H22N4O3/c1-26-18-14-15(24-20(28)19-17(22)6-5-9-23-19)7-8-16(18)21(25-26)29-13-12-27-10-3-2-4-11-27;1-25-19-15-16(23-20(27)18-7-3-4-10-22-18)8-9-17(19)21(24-25)28-14-13-26-11-5-2-6-12-26;1-12-10-14(7-9-27-12)28-20-15-6-5-13(11-17(15)25(2)24-20)23-19(26)18-16(21)4-3-8-22-18;1-12-10-14(7-9-27-12)28-20-15-6-5-13(11-16(15)24(2)23-20)22-19(26)18-17(25)4-3-8-21-18;1-13-11-15(8-10-26-13)27-20-16-7-6-14(12-18(16)24(2)23-20)22-19(25)17-5-3-4-9-21-17/h5-9,14H,2-4,10-13,22H2,1H3,(H,24,28);3-4,7-10,15H,2,5-6,11-14H2,1H3,(H,23,27);3-6,8,11-12,14H,7,9-10,21H2,1-2H3,(H,23,26);3-6,8,11-12,14,25H,7,9-10H2,1-2H3,(H,22,26);3-7,9,12-13,15H,8,10-11H2,1-2H3,(H,22,25) |
| InChIKey | JSZQBGXLYLJXRI-UHFFFAOYSA-N |
| XLogP | 14.54 |
| TPSA | 451.64 Ų |
| H-Bond Donors | 8 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 140 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1904.22 |
| LogP ≤ 5 | 14.54 |
| H-Bond Donors ≤ 5 | 8 |
| H-Bond Acceptors ≤ 10 | 33 |