1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate

C19H45NO6Si4 — CID 87342818

IUPAC1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate
SMILESC=C(C)CON(CC)C(=O)OC(CC)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C19H45NO6Si4/c1-14-18(23-19(21)20(15-2)22-16-17(3)4)30(24-27(5,6)7,25-28(8,9)10)26-29(11,12)13/h18H,3,14-16H2,1-2,4-13H3
InChIKeyFNDKQQHMAOBCKF-UHFFFAOYSA-N
MW495.91 g/mol
LogP5.76
Rot. Bonds13

About 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate

1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate (PubChem CID 87342818) has the molecular formula C19H45NO6Si4 and a molecular weight of 495.91 g/mol. Its IUPAC name is 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate.

Molecular Properties

Compound Name1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate
PubChem CID87342818
Molecular FormulaC19H45NO6Si4
Molecular Weight495.91 g/mol
Exact Mass495.23
IUPAC Name1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate
SMILESC=C(C)CON(CC)C(=O)OC(CC)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C19H45NO6Si4/c1-14-18(23-19(21)20(15-2)22-16-17(3)4)30(24-27(5,6)7,25-28(8,9)10)26-29(11,12)13/h18H,3,14-16H2,1-2,4-13H3
InChIKeyFNDKQQHMAOBCKF-UHFFFAOYSA-N
XLogP5.76
TPSA66.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500495.91
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,3,5-tris(aziridin-1-yl)cyclohexa-2,5-diene-1,4-dione;1-tris(trimethylsilyloxy)silylpropyl 2-methylprop-2-enoate
CID 87356592
trimethyl(2-methylprop-2-enoxy)silane
CID 582142
[2-hydroxy-3-[1-tris(trimethylsilyloxy)silylpropoxy]propyl] 2-methylprop-2-enoate
CID 22134039
trimethyl-[methyl-(2-methylprop-2-enoxy)-propylsilyl]oxysilane
CID 87705691
4-O-(1,2,2,3,3,4,5,5-octafluoropentyl) 1-O-[1-tris(trimethylsilyloxy)silylpropyl] but-2-enedioate
CID 173346817
2-methyl-N-[1-tris(trimethylsilyloxy)silylpropyl]prop-2-enamide
CID 18769275
1-tris[[ethenyl(dimethyl)silyl]oxy]silylpropyl prop-2-enoate
CID 87532765
chloro-dimethyl-[(1S)-1-(2-methylprop-2-enoxy)propyl]silane
CID 87393831
2-amino-2-(hydroxymethyl)propane-1,3-diol;pyrrolidin-2-one;1-tris(trimethylsilyloxy)silylpropyl 2-methylprop-2-enoate
CID 67766613
(5-methyl-5-silyloxyhexan-3-yl) 2-methylprop-2-enoate;[1-silyl-1,1-bis(trimethylsilyloxy)butan-2-yl] 2-methylprop-2-enoate;1-tris(trimethylsilyloxy)silylpropyl 2-methylprop-2-enoate
CID 173156428
(2-methylprop-2-enoxy-propyl-trimethylsilyloxysilyl)methanol
CID 88520936
dimethoxy-bis[1-(2-methylprop-2-enoxy)propyl]silane
CID 87898874

Frequently Asked Questions

What is the IUPAC name of 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate?
The IUPAC name of 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate (CID 87342818) is 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate.
What is the SMILES notation for 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate?
The canonical SMILES for 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate is C=C(C)CON(CC)C(=O)OC(CC)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate?
The InChIKey is FNDKQQHMAOBCKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H45NO6Si4/c1-14-18(23-19(21)20(15-2)22-16-17(3)4)30(24-27(5,6)7,25-28(8,9)10)26-29(11,12)13/h18H,3,14-16H2,1-2,4-13H3.
What are the key properties of 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate?
1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate has a molecular weight of 495.91 g/mol, XLogP of 5.76, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tris(trimethylsilyloxy)silylpropyl N-ethyl-N-(2-methylprop-2-enoxy)carbamate is sourced from PubChem (CID 87342818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).