C256H425N29O29 — CID 158413536
N-benzyl-N-heptyl-2-methylprop-2-enamide;N-[2,2-bis[(2-methylprop-2-enoylamino)methyl]butyl]-2-methylprop-2-enamide;N-butyl-N-cyclohexyl-2-methylprop-2-enamide;N,N-diethyl-2-methylprop-2-enamide;N,2-dimethyl-N-[[4-[[methyl(2-methylprop-2-enoyl)amino]methyl]phenyl]methyl]prop-2-enamide;N,2-dimethyl-N-[3-[3-[methyl(2-methylprop-2-enoyl)amino]propyl-(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3-[methyl(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3,3,5-trimethyl-6-[methyl(2-methylprop-2-enoyl)amino]hexyl]prop-2-enamide;N-ethyl-N-[[4-[[ethyl(2-methylprop-2-enoyl)amino]methyl]cyclohexyl]methyl]-2-methylprop-2-enamide;N-ethyl-N-[3-[ethyl(2-methylprop-2-enoyl)amino]propyl]-2-methylprop-2-enamide;N-heptyl-N,2-dimethylprop-2-enamide;N-[2-[[(1-hydroxy-2-methylprop-2-enyl)amino]methyl]-3-(2-methylprop-2-enoylamino)-2-[(2-methylprop-2-enoylamino)methyl]propyl]-2-methylprop-2-enamide;2-methyl-N-[[8-[(2-methylprop-2-enoylamino)methyl]-3-tricyclo[5.2.1.02,6]decanyl]methyl]prop-2-enamide;2-methyl-N-[(E)-4-[2-methylprop-2-enoyl(prop-2-enyl)amino]but-2-enyl]-N-prop-2-enylprop-2-enamide;2-methyl-N-octadecylprop-2-enamide (PubChem CID 158413536) has the molecular formula C256H425N29O29 and a molecular weight of 4373.39 g/mol. Its IUPAC name is N-benzyl-N-heptyl-2-methylprop-2-enamide;N-[2,2-bis[(2-methylprop-2-enoylamino)methyl]butyl]-2-methylprop-2-enamide;N-butyl-N-cyclohexyl-2-methylprop-2-enamide;N,N-diethyl-2-methylprop-2-enamide;N,2-dimethyl-N-[[4-[[methyl(2-methylprop-2-enoyl)amino]methyl]phenyl]methyl]prop-2-enamide;N,2-dimethyl-N-[3-[3-[methyl(2-methylprop-2-enoyl)amino]propyl-(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3-[methyl(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3,3,5-trimethyl-6-[methyl(2-methylprop-2-enoyl)amino]hexyl]prop-2-enamide;N-ethyl-N-[[4-[[ethyl(2-methylprop-2-enoyl)amino]methyl]cyclohexyl]methyl]-2-methylprop-2-enamide;N-ethyl-N-[3-[ethyl(2-methylprop-2-enoyl)amino]propyl]-2-methylprop-2-enamide;N-heptyl-N,2-dimethylprop-2-enamide;N-[2-[[(1-hydroxy-2-methylprop-2-enyl)amino]methyl]-3-(2-methylprop-2-enoylamino)-2-[(2-methylprop-2-enoylamino)methyl]propyl]-2-methylprop-2-enamide;2-methyl-N-[[8-[(2-methylprop-2-enoylamino)methyl]-3-tricyclo[5.2.1.02,6]decanyl]methyl]prop-2-enamide;2-methyl-N-[(E)-4-[2-methylprop-2-enoyl(prop-2-enyl)amino]but-2-enyl]-N-prop-2-enylprop-2-enamide;2-methyl-N-octadecylprop-2-enamide.
| Compound Name | N-benzyl-N-heptyl-2-methylprop-2-enamide;N-[2,2-bis[(2-methylprop-2-enoylamino)methyl]butyl]-2-methylprop-2-enamide;N-butyl-N-cyclohexyl-2-methylprop-2-enamide;N,N-diethyl-2-methylprop-2-enamide;N,2-dimethyl-N-[[4-[[methyl(2-methylprop-2-enoyl)amino]methyl]phenyl]methyl]prop-2-enamide;N,2-dimethyl-N-[3-[3-[methyl(2-methylprop-2-enoyl)amino]propyl-(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3-[methyl(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3,3,5-trimethyl-6-[methyl(2-methylprop-2-enoyl)amino]hexyl]prop-2-enamide;N-ethyl-N-[[4-[[ethyl(2-methylprop-2-enoyl)amino]methyl]cyclohexyl]methyl]-2-methylprop-2-enamide;N-ethyl-N-[3-[ethyl(2-methylprop-2-enoyl)amino]propyl]-2-methylprop-2-enamide;N-heptyl-N,2-dimethylprop-2-enamide;N-[2-[[(1-hydroxy-2-methylprop-2-enyl)amino]methyl]-3-(2-methylprop-2-enoylamino)-2-[(2-methylprop-2-enoylamino)methyl]propyl]-2-methylprop-2-enamide;2-methyl-N-[[8-[(2-methylprop-2-enoylamino)methyl]-3-tricyclo[5.2.1.02,6]decanyl]methyl]prop-2-enamide;2-methyl-N-[(E)-4-[2-methylprop-2-enoyl(prop-2-enyl)amino]but-2-enyl]-N-prop-2-enylprop-2-enamide;2-methyl-N-octadecylprop-2-enamide |
|---|---|
| PubChem CID | 158413536 |
| Molecular Formula | C256H425N29O29 |
| Molecular Weight | 4373.39 g/mol |
| Exact Mass | 4370.27 |
| IUPAC Name | N-benzyl-N-heptyl-2-methylprop-2-enamide;N-[2,2-bis[(2-methylprop-2-enoylamino)methyl]butyl]-2-methylprop-2-enamide;N-butyl-N-cyclohexyl-2-methylprop-2-enamide;N,N-diethyl-2-methylprop-2-enamide;N,2-dimethyl-N-[[4-[[methyl(2-methylprop-2-enoyl)amino]methyl]phenyl]methyl]prop-2-enamide;N,2-dimethyl-N-[3-[3-[methyl(2-methylprop-2-enoyl)amino]propyl-(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3-[methyl(2-methylprop-2-enoyl)amino]propyl]prop-2-enamide;N,2-dimethyl-N-[3,3,5-trimethyl-6-[methyl(2-methylprop-2-enoyl)amino]hexyl]prop-2-enamide;N-ethyl-N-[[4-[[ethyl(2-methylprop-2-enoyl)amino]methyl]cyclohexyl]methyl]-2-methylprop-2-enamide;N-ethyl-N-[3-[ethyl(2-methylprop-2-enoyl)amino]propyl]-2-methylprop-2-enamide;N-heptyl-N,2-dimethylprop-2-enamide;N-[2-[[(1-hydroxy-2-methylprop-2-enyl)amino]methyl]-3-(2-methylprop-2-enoylamino)-2-[(2-methylprop-2-enoylamino)methyl]propyl]-2-methylprop-2-enamide;2-methyl-N-[[8-[(2-methylprop-2-enoylamino)methyl]-3-tricyclo[5.2.1.02,6]decanyl]methyl]prop-2-enamide;2-methyl-N-[(E)-4-[2-methylprop-2-enoyl(prop-2-enyl)amino]but-2-enyl]-N-prop-2-enylprop-2-enamide;2-methyl-N-octadecylprop-2-enamide |
| SMILES | C=C(C)C(=O)N(C)CCC(C)(C)CC(C)CN(C)C(=O)C(=C)C.C=C(C)C(=O)N(C)CCCCCCC.C=C(C)C(=O)N(C)CCCN(C)C(=O)C(=C)C.C=C(C)C(=O)N(C)CCCN(CCCN(C)C(=O)C(=C)C)C(=O)C(=C)C.C=C(C)C(=O)N(C)Cc1ccc(CN(C)C(=O)C(=C)C)cc1.C=C(C)C(=O)N(CC)CC.C=C(C)C(=O)N(CC)CC1CCC(CN(CC)C(=O)C(=C)C)CC1.C=C(C)C(=O)N(CC)CCCN(CC)C(=O)C(=C)C.C=C(C)C(=O)N(CCCC)C1CCCCC1.C=C(C)C(=O)N(CCCCCCC)Cc1ccccc1.C=C(C)C(=O)NCC(CC)(CNC(=O)C(=C)C)CNC(=O)C(=C)C.C=C(C)C(=O)NCC(CNC(=O)C(=C)C)(CNC(=O)C(=C)C)CNC(O)C(=C)C.C=C(C)C(=O)NCC1CC2CC1C1CCC(CNC(=O)C(=C)C)C21.C=C(C)C(=O)NCCCCCCCCCCCCCCCCCC.C=CCN(C/C=C/CN(CC=C)C(=O)C(=C)C)C(=O)C(=C)C |
| InChI | InChI=1S/C22H43NO.C21H34N4O4.C20H33N3O3.C20H30N2O2.C20H34N2O2.C19H34N2O2.C18H29N3O3.C18H24N2O2.C18H26N2O2.C18H27NO.C15H26N2O2.C14H25NO.C13H22N2O2.C12H23NO.C8H15NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-22(24)21(2)3;1-13(2)17(26)22-9-21(10-23-18(27)14(3)4,11-24-19(28)15(5)6)12-25-20(29)16(7)8;1-15(2)18(24)21(7)11-9-13-23(20(26)17(5)6)14-10-12-22(8)19(25)16(3)4;1-11(2)19(23)21-9-13-5-6-16-17-8-14(18(13)16)7-15(17)10-22-20(24)12(3)4;1-7-21(19(23)15(3)4)13-17-9-11-18(12-10-17)14-22(8-2)20(24)16(5)6;1-14(2)17(22)20(8)11-10-19(6,7)12-16(5)13-21(9)18(23)15(3)4;1-8-18(9-19-15(22)12(2)3,10-20-16(23)13(4)5)11-21-17(24)14(6)7;1-13(2)17(21)19(5)11-15-7-9-16(10-8-15)12-20(6)18(22)14(3)4;1-7-11-19(17(21)15(3)4)13-9-10-14-20(12-8-2)18(22)16(5)6;1-4-5-6-7-11-14-19(18(20)16(2)3)15-17-12-9-8-10-13-17;1-7-16(14(18)12(3)4)10-9-11-17(8-2)15(19)13(5)6;1-4-5-11-15(14(16)12(2)3)13-9-7-6-8-10-13;1-10(2)12(16)14(5)8-7-9-15(6)13(17)11(3)4;1-5-6-7-8-9-10-13(4)12(14)11(2)3;1-5-9(6-2)8(10)7(3)4/h2,4-20H2,1,3H3,(H,23,24);17,22,26H,1,3,5,7,9-12H2,2,4,6,8H3,(H,23,27)(H,24,28)(H,25,29);1,3,5,9-14H2,2,4,6-8H3;13-18H,1,3,5-10H2,2,4H3,(H,21,23)(H,22,24);17-18H,3,5,7-14H2,1-2,4,6H3;16H,1,3,10-13H2,2,4-9H3;2,4,6,8-11H2,1,3,5,7H3,(H,19,22)(H,20,23)(H,21,24);7-10H,1,3,11-12H2,2,4-6H3;7-10H,1-3,5,11-14H2,4,6H3;8-10,12-13H,2,4-7,11,14-15H2,1,3H3;3,5,7-11H2,1-2,4,6H3;13H,2,4-11H2,1,3H3;1,3,7-9H2,2,4-6H3;2,5-10H2,1,3-4H3;3,5-6H2,1-2,4H3/b;;;;;;;;10-9+;;;;;; |
| InChIKey | GZPHGQGBWWBLHM-GZQCBKGPSA-N |
| XLogP | 42.64 |
| TPSA | 680.05 Ų |
| H-Bond Donors | 11 |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 129 |
| Heavy Atoms | 314 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4373.39 |
| LogP ≤ 5 | 42.64 |
| H-Bond Donors ≤ 5 | 11 |
| H-Bond Acceptors ≤ 10 | 30 |