N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide

C17H35NO3Si — CID 169083674

IUPACN-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCCCCCCC[Si](C)(OCC)OCC
InChIInChI=1S/C17H35NO3Si/c1-6-20-22(5,21-7-2)15-13-11-9-8-10-12-14-18-17(19)16(3)4/h3,6-15H2,1-2,4-5H3,(H,18,19)
InChIKeyZYJYATCAFCHYDK-UHFFFAOYSA-N
MW329.56 g/mol
LogP4.16
Rot. Bonds14

About N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide

N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide (PubChem CID 169083674) has the molecular formula C17H35NO3Si and a molecular weight of 329.56 g/mol. Its IUPAC name is N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide.

Molecular Properties

Compound NameN-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide
PubChem CID169083674
Molecular FormulaC17H35NO3Si
Molecular Weight329.56 g/mol
Exact Mass329.24
IUPAC NameN-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide
SMILESC=C(C)C(=O)NCCCCCCCC[Si](C)(OCC)OCC
InChIInChI=1S/C17H35NO3Si/c1-6-20-22(5,21-7-2)15-13-11-9-8-10-12-14-18-17(19)16(3)4/h3,6-15H2,1-2,4-5H3,(H,18,19)
InChIKeyZYJYATCAFCHYDK-UHFFFAOYSA-N
XLogP4.16
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.56
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(6-triethoxysilylhexyl)prop-2-enamide
CID 58330356
N-[8-[hydroxy(dimethyl)silyl]octyl]-2-methylprop-2-enamide
CID 162481107
N-icosyl-2-methylprop-2-enamide
CID 22336363
ethyl N-[4-[diethoxy(methyl)silyl]butyl]carbamate
CID 22065744
N-[12-[diethoxy(methyl)silyl]dodecyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide
CID 174145593
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-(propylamino)hexyl]prop-2-enamide
CID 18464100
methyl N-[3-[diethoxy(methyl)silyl]propyl]carbamate
CID 22065771
N-(5-methoxypentyl)-2-methylprop-2-enamide
CID 137383659
N-(8-aminooctyl)-2-methylprop-2-enamide
CID 86094836
[acetyloxy-[3-(2-methylprop-2-enoylamino)propyl]-octylsilyl] acetate
CID 88654942
2-methyl-N-(4-pentoxybutyl)prop-2-enamide
CID 102118160

Frequently Asked Questions

What is the IUPAC name of N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide?
The IUPAC name of N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide (CID 169083674) is N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide.
What is the SMILES notation for N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide?
The canonical SMILES for N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide is C=C(C)C(=O)NCCCCCCCC[Si](C)(OCC)OCC.
What is the InChIKey of N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide?
The InChIKey is ZYJYATCAFCHYDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO3Si/c1-6-20-22(5,21-7-2)15-13-11-9-8-10-12-14-18-17(19)16(3)4/h3,6-15H2,1-2,4-5H3,(H,18,19).
What are the key properties of N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide?
N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide has a molecular weight of 329.56 g/mol, XLogP of 4.16, 14 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide is sourced from PubChem (CID 169083674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).