N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide

C18H43NO4Si4 — CID 54350346

IUPACN-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)CCC
InChIInChI=1S/C18H43NO4Si4/c1-12-15-26(10,11)23-27(21-24(4,5)6,22-25(7,8)9)16-13-14-19-18(20)17(2)3/h2,12-16H2,1,3-11H3,(H,19,20)
InChIKeyUFGZDMJAQJPXSZ-UHFFFAOYSA-N
MW449.89 g/mol
LogP5.34
Rot. Bonds13

About N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide

N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide (PubChem CID 54350346) has the molecular formula C18H43NO4Si4 and a molecular weight of 449.89 g/mol. Its IUPAC name is N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide
PubChem CID54350346
Molecular FormulaC18H43NO4Si4
Molecular Weight449.89 g/mol
Exact Mass449.23
IUPAC NameN-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)CCC
InChIInChI=1S/C18H43NO4Si4/c1-12-15-26(10,11)23-27(21-24(4,5)6,22-25(7,8)9)16-13-14-19-18(20)17(2)3/h2,12-16H2,1,3-11H3,(H,19,20)
InChIKeyUFGZDMJAQJPXSZ-UHFFFAOYSA-N
XLogP5.34
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.89
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-[3-tris[[ethyl(dimethyl)silyl]oxy]silylpropyl]prop-2-enamide
CID 54537406
2-methyl-N-[4-[[4-(2-methylprop-2-enoylamino)butyl-bis(trimethylsilyloxy)silyl]oxy-bis(trimethylsilyloxy)silyl]butyl]prop-2-enamide
CID 87119608
2-methyl-N-(6-triethoxysilylhexyl)prop-2-enamide
CID 58330356
3-tris[[dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silyl]oxy]silylpropyl 2-methylprop-2-enoate
CID 88568225
4-[[2-[dimethyl(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-dimethylsilyl]butyl-dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azanium;hydrobromide
CID 157309870
N-icosyl-2-methylprop-2-enamide
CID 22336363
butyl-tris(trimethylsilyloxy)silane
CID 19881442
N-(3-aminopropyl)-2-methylprop-2-enamide
CID 158225145
N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide
CID 169083674
[acetyloxy-[3-(2-methylprop-2-enoylamino)propyl]-octylsilyl] acetate
CID 88654942
2-methyl-N-propylprop-2-enamide;hydrobromide
CID 172725706
2-methyl-N-propylprop-2-enamide;hydrochloride
CID 87485783

Frequently Asked Questions

What is the IUPAC name of N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide?
The IUPAC name of N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide (CID 54350346) is N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide.
What is the SMILES notation for N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide?
The canonical SMILES for N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide is C=C(C)C(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)CCC.
What is the InChIKey of N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide?
The InChIKey is UFGZDMJAQJPXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H43NO4Si4/c1-12-15-26(10,11)23-27(21-24(4,5)6,22-25(7,8)9)16-13-14-19-18(20)17(2)3/h2,12-16H2,1,3-11H3,(H,19,20).
What are the key properties of N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide?
N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide has a molecular weight of 449.89 g/mol, XLogP of 5.34, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[dimethyl(propyl)silyl]oxy-bis(trimethylsilyloxy)silyl]propyl]-2-methylprop-2-enamide is sourced from PubChem (CID 54350346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).