C112H172N2O51 — CID 158726664
2-methyl-N-[2-[2-[2-[2-(2-methylprop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]prop-2-enamide;2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethoxymethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate;2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethyl prop-2-enoate;2-(2-prop-2-enoyloxyethoxy)ethyl prop-2-enoate;prop-2-enoyloxymethoxymethyl prop-2-enoate (PubChem CID 158726664) has the molecular formula C112H172N2O51 and a molecular weight of 2362.57 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-[2-[2-(2-methylprop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]prop-2-enamide;2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethoxymethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate;2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethyl prop-2-enoate;2-(2-prop-2-enoyloxyethoxy)ethyl prop-2-enoate;prop-2-enoyloxymethoxymethyl prop-2-enoate.
| Compound Name | 2-methyl-N-[2-[2-[2-[2-(2-methylprop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]prop-2-enamide;2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethoxymethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate;2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethyl prop-2-enoate;2-(2-prop-2-enoyloxyethoxy)ethyl prop-2-enoate;prop-2-enoyloxymethoxymethyl prop-2-enoate |
|---|---|
| PubChem CID | 158726664 |
| Molecular Formula | C112H172N2O51 |
| Molecular Weight | 2362.57 g/mol |
| Exact Mass | 2361.09 |
| IUPAC Name | 2-methyl-N-[2-[2-[2-[2-(2-methylprop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]prop-2-enamide;2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate;2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethyl 2-methylprop-2-enoate;2-methylprop-2-enoyloxymethoxymethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate;2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethyl prop-2-enoate;2-(2-prop-2-enoyloxyethoxy)ethyl prop-2-enoate;prop-2-enoyloxymethoxymethyl prop-2-enoate |
| SMILES | C=C(C)C(=O)NCCOCCOCCOCCNC(=O)C(=C)C.C=C(C)C(=O)OCCOCCOC(=O)C(=C)C.C=C(C)C(=O)OCCOCCOCCOC(=O)C(=C)C.C=C(C)C(=O)OCCOCCOCCOCCOC(=O)C(=C)C.C=C(C)C(=O)OCOCOC(=O)C(=C)C.C=CC(=O)OCCOCCOC(=O)C=C.C=CC(=O)OCCOCCOCCOC(=O)C=C.C=CC(=O)OCCOCCOCCOCCOC(=O)C=C.C=CC(=O)OCOCOC(=O)C=C |
| InChI | InChI=1S/C16H28N2O5.C16H26O7.C14H22O7.C14H22O6.C12H18O6.C12H18O5.2C10H14O5.C8H10O5/c1-13(2)15(19)17-5-7-21-9-11-23-12-10-22-8-6-18-16(20)14(3)4;1-13(2)15(17)22-11-9-20-7-5-19-6-8-21-10-12-23-16(18)14(3)4;1-3-13(15)20-11-9-18-7-5-17-6-8-19-10-12-21-14(16)4-2;1-11(2)13(15)19-9-7-17-5-6-18-8-10-20-14(16)12(3)4;1-3-11(13)17-9-7-15-5-6-16-8-10-18-12(14)4-2;1-9(2)11(13)16-7-5-15-6-8-17-12(14)10(3)4;1-7(2)9(11)14-5-13-6-15-10(12)8(3)4;1-3-9(11)14-7-5-13-6-8-15-10(12)4-2;1-3-7(9)12-5-11-6-13-8(10)4-2/h1,3,5-12H2,2,4H3,(H,17,19)(H,18,20);1,3,5-12H2,2,4H3;3-4H,1-2,5-12H2;1,3,5-10H2,2,4H3;3-4H,1-2,5-10H2;1,3,5-8H2,2,4H3;1,3,5-6H2,2,4H3;3-4H,1-2,5-8H2;3-4H,1-2,5-6H2 |
| InChIKey | IKOVZMOWQVPPLY-UHFFFAOYSA-N |
| XLogP | 7.16 |
| TPSA | 635.91 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 51 |
| Rotatable Bonds | 92 |
| Heavy Atoms | 165 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2362.57 |
| LogP ≤ 5 | 7.16 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 51 |
| Structural Alerts | {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'} |
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