1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)

C56H106N2O25Si3 — CID 158398630

About 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)

1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate) (PubChem CID 158398630) has the molecular formula C56H106N2O25Si3 and a molecular weight of 1291.71 g/mol. Its IUPAC name is 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate).

Molecular Properties

• Compound Name: 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)
• PubChem CID: 158398630
• Molecular Formula: C56H106N2O25Si3
• Molecular Weight: 1291.71 g/mol
• Exact Mass: 1290.64
• IUPAC Name: 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)
• SMILES: C=C(OC(=O)CCN(CCO)CCO)OC(=O)C(=C)C.C=CC(=O)OC(=C)OC(=O)C(=C)C.C=CC(=O)OC(=C)OC(=O)C(=C)C.COCCC[Si](C)(OC)OC.COCCC[Si](C)(OC)OC.COCCC[Si](C)(OC)OC.OCCNCCO
• InChI: InChI=1S/C13H21NO6.2C9H10O4.3C7H18O3Si.C4H11NO2/c1-10(2)13(18)20-11(3)19-12(17)4-5-14(6-8-15)7-9-16;2*1-5-8(10)12-7(4)13-9(11)6(2)3;3*1-8-6-5-7-11(4,9-2)10-3;6-3-1-5-2-4-7/h15-16H,1,3-9H2,2H3;2*5H,1-2,4H2,3H3;3*5-7H2,1-4H3;5-7H,1-4H2
• InChIKey: GXVGKTGJOYUOBL-UHFFFAOYSA-N
• XLogP: 5.13
• TPSA: 337.06 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 27
• Rotatable Bonds: 40
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1291.71
LogP ≤ 5	5.13
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)?

The IUPAC name of 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate) (CID 158398630) is 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate).

What is the SMILES notation for 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)?

The canonical SMILES for 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate) is C=C(OC(=O)CCN(CCO)CCO)OC(=O)C(=C)C.C=CC(=O)OC(=C)OC(=O)C(=C)C.C=CC(=O)OC(=C)OC(=O)C(=C)C.COCCC[Si](C)(OC)OC.COCCC[Si](C)(OC)OC.COCCC[Si](C)(OC)OC.OCCNCCO.

What is the InChIKey of 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)?

The InChIKey is GXVGKTGJOYUOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO6.2C9H10O4.3C7H18O3Si.C4H11NO2/c1-10(2)13(18)20-11(3)19-12(17)4-5-14(6-8-15)7-9-16;2*1-5-8(10)12-7(4)13-9(11)6(2)3;3*1-8-6-5-7-11(4,9-2)10-3;6-3-1-5-2-4-7/h15-16H,1,3-9H2,2H3;2*5H,1-2,4H2,3H3;3*5-7H2,1-4H3;5-7H,1-4H2.

What are the key properties of 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate)?

1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate) has a molecular weight of 1291.71 g/mol, XLogP of 5.13, 40 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-[bis(2-hydroxyethyl)amino]propanoyloxy]ethenyl 2-methylprop-2-enoate;tris(dimethoxy-(3-methoxypropyl)-methylsilane);2-(2-hydroxyethylamino)ethanol;bis(1-prop-2-enoyloxyethenyl 2-methylprop-2-enoate) is sourced from PubChem (CID 158398630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).