C202H251F4N19O4 — CID 161048295
N-benzyl-4-propan-2-ylpyridin-2-amine;2-(cyclohexylmethyl)-6-methyl-4-propan-2-ylpyridine;6-(cyclohexylmethyl)-4-propan-2-yl-1H-pyridin-2-one;N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridin-2-amine;bis(2-methyl-6-(2-phenylethyl)-4-propan-2-ylpyridine);6-(2-phenylethyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine;bis(6-(2-phenylethyl)-4-propan-2-yl-1H-pyridin-2-one);6-(2-phenylethyl)-4-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-(2-phenylethyl)-4-propan-2-yl-6-(trifluoromethyl)pyridine;4-propan-2-yl-1H-pyridin-2-one;4-propan-2-yl-N-(pyridin-2-ylmethyl)pyridin-2-amine (PubChem CID 161048295) has the molecular formula C202H251F4N19O4 and a molecular weight of 3085.35 g/mol. Its IUPAC name is N-benzyl-4-propan-2-ylpyridin-2-amine;2-(cyclohexylmethyl)-6-methyl-4-propan-2-ylpyridine;6-(cyclohexylmethyl)-4-propan-2-yl-1H-pyridin-2-one;N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridin-2-amine;bis(2-methyl-6-(2-phenylethyl)-4-propan-2-ylpyridine);6-(2-phenylethyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine;bis(6-(2-phenylethyl)-4-propan-2-yl-1H-pyridin-2-one);6-(2-phenylethyl)-4-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-(2-phenylethyl)-4-propan-2-yl-6-(trifluoromethyl)pyridine;4-propan-2-yl-1H-pyridin-2-one;4-propan-2-yl-N-(pyridin-2-ylmethyl)pyridin-2-amine.
| Compound Name | N-benzyl-4-propan-2-ylpyridin-2-amine;2-(cyclohexylmethyl)-6-methyl-4-propan-2-ylpyridine;6-(cyclohexylmethyl)-4-propan-2-yl-1H-pyridin-2-one;N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridin-2-amine;bis(2-methyl-6-(2-phenylethyl)-4-propan-2-ylpyridine);6-(2-phenylethyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine;bis(6-(2-phenylethyl)-4-propan-2-yl-1H-pyridin-2-one);6-(2-phenylethyl)-4-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-(2-phenylethyl)-4-propan-2-yl-6-(trifluoromethyl)pyridine;4-propan-2-yl-1H-pyridin-2-one;4-propan-2-yl-N-(pyridin-2-ylmethyl)pyridin-2-amine |
|---|---|
| PubChem CID | 161048295 |
| Molecular Formula | C202H251F4N19O4 |
| Molecular Weight | 3085.35 g/mol |
| Exact Mass | 3083.00 |
| IUPAC Name | N-benzyl-4-propan-2-ylpyridin-2-amine;2-(cyclohexylmethyl)-6-methyl-4-propan-2-ylpyridine;6-(cyclohexylmethyl)-4-propan-2-yl-1H-pyridin-2-one;N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridin-2-amine;bis(2-methyl-6-(2-phenylethyl)-4-propan-2-ylpyridine);6-(2-phenylethyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine;bis(6-(2-phenylethyl)-4-propan-2-yl-1H-pyridin-2-one);6-(2-phenylethyl)-4-propan-2-yl-1H-pyrrolo[2,3-b]pyridine;2-(2-phenylethyl)-4-propan-2-yl-6-(trifluoromethyl)pyridine;4-propan-2-yl-1H-pyridin-2-one;4-propan-2-yl-N-(pyridin-2-ylmethyl)pyridin-2-amine |
| SMILES | CC(C)c1cc(CC2CCCCC2)[nH]c(=O)c1.CC(C)c1cc(CCc2ccccc2)[nH]c(=O)c1.CC(C)c1cc(CCc2ccccc2)[nH]c(=O)c1.CC(C)c1cc(CCc2ccccc2)nc(C(F)(F)F)c1.CC(C)c1cc(CCc2ccccc2)nc2[nH]ccc12.CC(C)c1cc(CCc2ccccc2)nc2c1CCN2.CC(C)c1cc[nH]c(=O)c1.CC(C)c1ccnc(NCc2ccc(F)cc2)c1.CC(C)c1ccnc(NCc2ccccc2)c1.CC(C)c1ccnc(NCc2ccccn2)c1.Cc1cc(C(C)C)cc(CC2CCCCC2)n1.Cc1cc(C(C)C)cc(CCc2ccccc2)n1.Cc1cc(C(C)C)cc(CCc2ccccc2)n1 |
| InChI | InChI=1S/C18H22N2.C18H20N2.C17H18F3N.2C17H21N.2C16H19NO.C16H25N.C15H17FN2.C15H18N2.C15H23NO.C14H17N3.C8H11NO/c2*1-13(2)17-12-15(20-18-16(17)10-11-19-18)9-8-14-6-4-3-5-7-14;1-12(2)14-10-15(21-16(11-14)17(18,19)20)9-8-13-6-4-3-5-7-13;2*1-13(2)16-11-14(3)18-17(12-16)10-9-15-7-5-4-6-8-15;2*1-12(2)14-10-15(17-16(18)11-14)9-8-13-6-4-3-5-7-13;1-12(2)15-9-13(3)17-16(11-15)10-14-7-5-4-6-8-14;1-11(2)13-7-8-17-15(9-13)18-10-12-3-5-14(16)6-4-12;1-12(2)14-8-9-16-15(10-14)17-11-13-6-4-3-5-7-13;1-11(2)13-9-14(16-15(17)10-13)8-12-6-4-3-5-7-12;1-11(2)12-6-8-16-14(9-12)17-10-13-5-3-4-7-15-13;1-6(2)7-3-4-9-8(10)5-7/h3-7,12-13H,8-11H2,1-2H3,(H,19,20);3-7,10-13H,8-9H2,1-2H3,(H,19,20);3-7,10-12H,8-9H2,1-2H3;2*4-8,11-13H,9-10H2,1-3H3;2*3-7,10-12H,8-9H2,1-2H3,(H,17,18);9,11-12,14H,4-8,10H2,1-3H3;3-9,11H,10H2,1-2H3,(H,17,18);3-10,12H,11H2,1-2H3,(H,16,17);9-12H,3-8H2,1-2H3,(H,16,17);3-9,11H,10H2,1-2H3,(H,16,17);3-6H,1-2H3,(H,9,10) |
| InChIKey | UBUFTSVHDSTRGR-UHFFFAOYSA-N |
| XLogP | 49.34 |
| TPSA | 324.25 Ų |
| H-Bond Donors | 9 |
| H-Bond Acceptors | 18 |
| Rotatable Bonds | 47 |
| Heavy Atoms | 229 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3085.35 |
| LogP ≤ 5 | 49.34 |
| H-Bond Donors ≤ 5 | 9 |
| H-Bond Acceptors ≤ 10 | 18 |