N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide

C13H27NO3Si — CID 139724660

IUPACN-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCC[Si](C)(OCC)OCC
InChIInChI=1S/C13H27NO3Si/c1-7-16-18(6,17-8-2)11-9-10-14(5)13(15)12(3)4/h3,7-11H2,1-2,4-6H3
InChIKeyFVQIQOJDRMWBRB-UHFFFAOYSA-N
MW273.45 g/mol
LogP2.56
Rot. Bonds9

About N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide

N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide (PubChem CID 139724660) has the molecular formula C13H27NO3Si and a molecular weight of 273.45 g/mol. Its IUPAC name is N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide.

Molecular Properties

Compound NameN-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide
PubChem CID139724660
Molecular FormulaC13H27NO3Si
Molecular Weight273.45 g/mol
Exact Mass273.18
IUPAC NameN-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCC[Si](C)(OCC)OCC
InChIInChI=1S/C13H27NO3Si/c1-7-16-18(6,17-8-2)11-9-10-14(5)13(15)12(3)4/h3,7-11H2,1-2,4-6H3
InChIKeyFVQIQOJDRMWBRB-UHFFFAOYSA-N
XLogP2.56
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.45
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[12-[diethoxy(methyl)silyl]dodecyl]-2-methyl-N-(2-methylprop-2-enoyl)prop-2-enamide
CID 174145593
N,2-dimethyl-N-tetracosylprop-2-enamide
CID 87262023
N-[8-[diethoxy(methyl)silyl]octyl]-2-methylprop-2-enamide
CID 169083674
3-[diethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;tetraethyl silicate
CID 87080022
3-[[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-[3-(dimethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-dimethylpropan-1-amine
CID 171623500
N,2-dimethyl-N-[3-[1-[3-[methyl(2-methylprop-2-enoyl)amino]propoxy]ethoxy]propyl]prop-2-enamide
CID 21285723
N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide
CID 59819360
triethylsilyl N-[3-(butan-2-yloxy-ethoxy-methylsilyl)propyl]-N-methylcarbamate
CID 140591113
[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-methylamino]propanoate
CID 88852298
N'-[3-[diethoxy(methyl)silyl]propyl]-N'-[3-(diethylamino)propyl]-N,N-diethylpropane-1,3-diamine
CID 140647314
bis[3-[diethoxy(methyl)silyl]propyl] carbonate
CID 54561598
N-(4-amino-4-methylpentyl)-N,2-dimethylprop-2-enamide
CID 138739134

Frequently Asked Questions

What is the IUPAC name of N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide?
The IUPAC name of N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide (CID 139724660) is N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide.
What is the SMILES notation for N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide?
The canonical SMILES for N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide is C=C(C)C(=O)N(C)CCC[Si](C)(OCC)OCC.
What is the InChIKey of N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide?
The InChIKey is FVQIQOJDRMWBRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3Si/c1-7-16-18(6,17-8-2)11-9-10-14(5)13(15)12(3)4/h3,7-11H2,1-2,4-6H3.
What are the key properties of N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide?
N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide has a molecular weight of 273.45 g/mol, XLogP of 2.56, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide is sourced from PubChem (CID 139724660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).