C135H128Cl5F5N28O10 — CID 159175220
5-chloro-N-[1-(1,5-dimethylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-6-fluoro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-4-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-7-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-(difluoromethyl)-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;6-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide (PubChem CID 159175220) has the molecular formula C135H128Cl5F5N28O10 and a molecular weight of 2574.95 g/mol. Its IUPAC name is 5-chloro-N-[1-(1,5-dimethylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-6-fluoro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-4-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-7-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-(difluoromethyl)-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;6-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide.
| Compound Name | 5-chloro-N-[1-(1,5-dimethylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-6-fluoro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-4-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-7-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-(difluoromethyl)-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;6-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide |
|---|---|
| PubChem CID | 159175220 |
| Molecular Formula | C135H128Cl5F5N28O10 |
| Molecular Weight | 2574.95 g/mol |
| Exact Mass | 2570.87 |
| IUPAC Name | 5-chloro-N-[1-(1,5-dimethylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-N-[1-(1-ethylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-6-fluoro-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-4-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-chloro-7-fluoro-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;6-(difluoromethyl)-N-[1-(1-methylpyrrol-3-yl)cyclopropyl]-1H-indole-2-carboxamide;5-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide;6-hydroxy-N-[1-(1-methylpyrazol-4-yl)cyclopropyl]-1H-indole-2-carboxamide |
| SMILES | CCn1ccc(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)c1.Cc1c(C2(NC(=O)c3cc4cc(Cl)ccc4[nH]3)CC2)cnn1C.Cn1cc(C2(NC(=O)c3cc4cc(Cl)c(F)cc4[nH]3)CC2)cn1.Cn1cc(C2(NC(=O)c3cc4cc(O)ccc4[nH]3)CC2)cn1.Cn1cc(C2(NC(=O)c3cc4ccc(O)cc4[nH]3)CC2)cn1.Cn1ccc(C2(NC(=O)c3cc4c(F)c(Cl)ccc4[nH]3)CC2)c1.Cn1ccc(C2(NC(=O)c3cc4cc(Cl)cc(F)c4[nH]3)CC2)c1.Cn1ccc(C2(NC(=O)c3cc4ccc(C(F)F)cc4[nH]3)CC2)c1 |
| InChI | InChI=1S/C18H18ClN3O.C18H17F2N3O.2C17H15ClFN3O.C17H17ClN4O.C16H14ClFN4O.2C16H16N4O2/c1-2-22-8-5-13(11-22)18(6-7-18)21-17(23)16-10-12-9-14(19)3-4-15(12)20-16;1-23-7-4-13(10-23)18(5-6-18)22-17(24)15-8-11-2-3-12(16(19)20)9-14(11)21-15;1-22-5-2-11(9-22)17(3-4-17)21-16(23)14-7-10-6-12(18)8-13(19)15(10)20-14;1-22-7-4-10(9-22)17(5-6-17)21-16(23)14-8-11-13(20-14)3-2-12(18)15(11)19;1-10-13(9-19-22(10)2)17(5-6-17)21-16(23)15-8-11-7-12(18)3-4-14(11)20-15;1-22-8-10(7-19-22)16(2-3-16)21-15(23)14-5-9-4-11(17)12(18)6-13(9)20-14;1-20-9-11(8-17-20)16(4-5-16)19-15(22)14-7-10-6-12(21)2-3-13(10)18-14;1-20-9-11(8-17-20)16(4-5-16)19-15(22)14-6-10-2-3-12(21)7-13(10)18-14/h3-5,8-11,20H,2,6-7H2,1H3,(H,21,23);2-4,7-10,16,21H,5-6H2,1H3,(H,22,24);2,5-9,20H,3-4H2,1H3,(H,21,23);2-4,7-9,20H,5-6H2,1H3,(H,21,23);3-4,7-9,20H,5-6H2,1-2H3,(H,21,23);4-8,20H,2-3H2,1H3,(H,21,23);2*2-3,6-9,18,21H,4-5H2,1H3,(H,19,22) |
| InChIKey | KMEPGGBUNVFWSD-UHFFFAOYSA-N |
| XLogP | 25.81 |
| TPSA | 490.58 Ų |
| H-Bond Donors | 18 |
| H-Bond Acceptors | 22 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 183 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2574.95 |
| LogP ≤ 5 | 25.81 |
| H-Bond Donors ≤ 5 | 18 |
| H-Bond Acceptors ≤ 10 | 22 |