C154H139Cl3F5N19O9 — CID 160756956
5-chloro-N-(1-cyclohexylethyl)-1H-indole-2-carboxamide;5-chloro-N-(2-phenylpropan-2-yl)-1H-indole-2-carboxamide;5-chloro-N-propan-2-yl-1H-indole-2-carboxamide;6-fluoro-N-naphthalen-1-yl-1H-indole-2-carboxamide;4-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1S)-1-phenylethyl]-1H-indole-2-carboxamide;6-fluoro-N-quinolin-5-yl-1H-indole-2-carboxamide;N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-indole-2-carboxamide (PubChem CID 160756956) has the molecular formula C154H139Cl3F5N19O9 and a molecular weight of 2601.28 g/mol. Its IUPAC name is 5-chloro-N-(1-cyclohexylethyl)-1H-indole-2-carboxamide;5-chloro-N-(2-phenylpropan-2-yl)-1H-indole-2-carboxamide;5-chloro-N-propan-2-yl-1H-indole-2-carboxamide;6-fluoro-N-naphthalen-1-yl-1H-indole-2-carboxamide;4-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1S)-1-phenylethyl]-1H-indole-2-carboxamide;6-fluoro-N-quinolin-5-yl-1H-indole-2-carboxamide;N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-indole-2-carboxamide.
| Compound Name | 5-chloro-N-(1-cyclohexylethyl)-1H-indole-2-carboxamide;5-chloro-N-(2-phenylpropan-2-yl)-1H-indole-2-carboxamide;5-chloro-N-propan-2-yl-1H-indole-2-carboxamide;6-fluoro-N-naphthalen-1-yl-1H-indole-2-carboxamide;4-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1S)-1-phenylethyl]-1H-indole-2-carboxamide;6-fluoro-N-quinolin-5-yl-1H-indole-2-carboxamide;N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-indole-2-carboxamide |
|---|---|
| PubChem CID | 160756956 |
| Molecular Formula | C154H139Cl3F5N19O9 |
| Molecular Weight | 2601.28 g/mol |
| Exact Mass | 2598.00 |
| IUPAC Name | 5-chloro-N-(1-cyclohexylethyl)-1H-indole-2-carboxamide;5-chloro-N-(2-phenylpropan-2-yl)-1H-indole-2-carboxamide;5-chloro-N-propan-2-yl-1H-indole-2-carboxamide;6-fluoro-N-naphthalen-1-yl-1H-indole-2-carboxamide;4-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1R)-1-phenylethyl]-1H-indole-2-carboxamide;7-fluoro-N-[(1S)-1-phenylethyl]-1H-indole-2-carboxamide;6-fluoro-N-quinolin-5-yl-1H-indole-2-carboxamide;N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-indole-2-carboxamide |
| SMILES | CC(C)(NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1.CC(C)NC(=O)c1cc2cc(Cl)ccc2[nH]1.CC(NC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCCCC1.C[C@@H](NC(=O)c1cc2c(F)cccc2[nH]1)c1ccccc1.C[C@@H](NC(=O)c1cc2cccc(F)c2[nH]1)c1ccccc1.C[C@H](NC(=O)c1cc2cccc(F)c2[nH]1)c1ccccc1.O=C(NC1CCCc2ccccc21)c1cc2ccccc2[nH]1.O=C(Nc1cccc2ccccc12)c1cc2ccc(F)cc2[nH]1.O=C(Nc1cccc2ncccc12)c1cc2ccc(F)cc2[nH]1 |
| InChI | InChI=1S/C19H13FN2O.C19H18N2O.C18H17ClN2O.C18H12FN3O.C17H21ClN2O.3C17H15FN2O.C12H13ClN2O/c20-14-9-8-13-10-18(21-17(13)11-14)19(23)22-16-7-3-5-12-4-1-2-6-15(12)16;22-19(18-12-14-7-2-4-10-16(14)20-18)21-17-11-5-8-13-6-1-3-9-15(13)17;1-18(2,13-6-4-3-5-7-13)21-17(22)16-11-12-10-14(19)8-9-15(12)20-16;19-12-7-6-11-9-17(21-16(11)10-12)18(23)22-15-5-1-4-14-13(15)3-2-8-20-14;1-11(12-5-3-2-4-6-12)19-17(21)16-10-13-9-14(18)7-8-15(13)20-16;1-11(12-6-3-2-4-7-12)19-17(21)16-10-13-14(18)8-5-9-15(13)20-16;2*1-11(12-6-3-2-4-7-12)19-17(21)15-10-13-8-5-9-14(18)16(13)20-15;1-7(2)14-12(16)11-6-8-5-9(13)3-4-10(8)15-11/h1-11,21H,(H,22,23);1-4,6-7,9-10,12,17,20H,5,8,11H2,(H,21,22);3-11,20H,1-2H3,(H,21,22);1-10,21H,(H,22,23);7-12,20H,2-6H2,1H3,(H,19,21);3*2-11,20H,1H3,(H,19,21);3-7,15H,1-2H3,(H,14,16)/t;;;;;3*11-;/m.....110./s1 |
| InChIKey | RXOFGXFSQJRZOD-NLVUXNOXSA-N |
| XLogP | 36.16 |
| TPSA | 416.90 Ų |
| H-Bond Donors | 18 |
| H-Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 190 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2601.28 |
| LogP ≤ 5 | 36.16 |
| H-Bond Donors ≤ 5 | 18 |
| H-Bond Acceptors ≤ 10 | 10 |