C134H132N26O9 — CID 158443316
N-(1,3-benzodioxol-5-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(3-benzylphenyl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-phenyl-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-pyridin-2-yl-1H-indazole-3-carboxamide (PubChem CID 158443316) has the molecular formula C134H132N26O9 and a molecular weight of 2250.70 g/mol. Its IUPAC name is N-(1,3-benzodioxol-5-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(3-benzylphenyl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-phenyl-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-pyridin-2-yl-1H-indazole-3-carboxamide.
| Compound Name | N-(1,3-benzodioxol-5-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(3-benzylphenyl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-phenyl-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-pyridin-2-yl-1H-indazole-3-carboxamide |
|---|---|
| PubChem CID | 158443316 |
| Molecular Formula | C134H132N26O9 |
| Molecular Weight | 2250.70 g/mol |
| Exact Mass | 2249.07 |
| IUPAC Name | N-(1,3-benzodioxol-5-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(3-benzylphenyl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-phenyl-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-pyridin-2-yl-1H-indazole-3-carboxamide |
| SMILES | O=C(Nc1ccc2c(c1)OCCO2)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12.O=C(Nc1ccc2c(c1)OCO2)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12.O=C(Nc1cccc(Cc2ccccc2)c1)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12.O=C(Nc1ccccc1)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12.O=C(Nc1ccccn1)c1n[nH]c2ccc(-c3cncc(CN4CCCCC4)c3)cc12 |
| InChI | InChI=1S/C32H31N5O.C27H27N5O3.C26H25N5O3.C25H25N5O.C24H24N6O/c38-32(34-28-11-7-10-24(18-28)16-23-8-3-1-4-9-23)31-29-19-26(12-13-30(29)35-36-31)27-17-25(20-33-21-27)22-37-14-5-2-6-15-37;33-27(29-21-5-7-24-25(14-21)35-11-10-34-24)26-22-13-19(4-6-23(22)30-31-26)20-12-18(15-28-16-20)17-32-8-2-1-3-9-32;32-26(28-20-5-7-23-24(12-20)34-16-33-23)25-21-11-18(4-6-22(21)29-30-25)19-10-17(13-27-14-19)15-31-8-2-1-3-9-31;31-25(27-21-7-3-1-4-8-21)24-22-14-19(9-10-23(22)28-29-24)20-13-18(15-26-16-20)17-30-11-5-2-6-12-30;31-24(27-22-6-2-3-9-26-22)23-20-13-18(7-8-21(20)28-29-23)19-12-17(14-25-15-19)16-30-10-4-1-5-11-30/h1,3-4,7-13,17-21H,2,5-6,14-16,22H2,(H,34,38)(H,35,36);4-7,12-16H,1-3,8-11,17H2,(H,29,33)(H,30,31);4-7,10-14H,1-3,8-9,15-16H2,(H,28,32)(H,29,30);1,3-4,7-10,13-16H,2,5-6,11-12,17H2,(H,27,31)(H,28,29);2-3,6-9,12-15H,1,4-5,10-11,16H2,(H,28,29)(H,26,27,31) |
| InChIKey | HDBULSALDCTVEV-UHFFFAOYSA-N |
| XLogP | 24.80 |
| TPSA | 419.36 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 25 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 169 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2250.70 |
| LogP ≤ 5 | 24.80 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 25 |