N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane

C17H35NO4Si — CID 174864706

IUPACN-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane
SMILESC=CC(=O)NC.CCOC1(CC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C13H28O3Si.C4H7NO/c1-5-13(14-6-2)11-9-10-12-17(13,15-7-3)16-8-4;1-3-4(6)5-2/h5-12H2,1-4H3;3H,1H2,2H3,(H,5,6)
InChIKeyMAHAPJKIYAAVCN-UHFFFAOYSA-N
MW345.56 g/mol
LogP3.33
Rot. Bonds8

About N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane

N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane (PubChem CID 174864706) has the molecular formula C17H35NO4Si and a molecular weight of 345.56 g/mol. Its IUPAC name is N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane.

Molecular Properties

Compound NameN-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane
PubChem CID174864706
Molecular FormulaC17H35NO4Si
Molecular Weight345.56 g/mol
Exact Mass345.23
IUPAC NameN-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane
SMILESC=CC(=O)NC.CCOC1(CC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C13H28O3Si.C4H7NO/c1-5-13(14-6-2)11-9-10-12-17(13,15-7-3)16-8-4;1-3-4(6)5-2/h5-12H2,1-4H3;3H,1H2,2H3,(H,5,6)
InChIKeyMAHAPJKIYAAVCN-UHFFFAOYSA-N
XLogP3.33
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.56
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

propanoic acid;1,1,2-triethoxy-2-ethylsilinane
CID 174783066
4-methylpent-1-ene;1,1,2-triethoxy-2-ethylsilinane
CID 174706087
[2-hydroxy-3-(propylamino)propyl] prop-2-enoate;1,1,2-triethoxy-2-ethylsilinane
CID 174964240
(1,1,2-triethoxysilinan-2-yl)methyl acetate
CID 174525349
4-chlorophenol;1,1,2-triethoxy-2-ethylsilinane
CID 174609070
toluene;1,1,2-triethoxy-2-ethylsilinane
CID 174816258
phenanthrene;1,1,2-triethoxy-2-ethylsilinane
CID 174932363
phenyl hypochlorite;1,1,2-triethoxy-2-ethylsilinane
CID 174609072
1,1,2,2-tetraethoxysilinane
CID 174248265
5-(1,1,2-triethoxysilinan-2-yl)pentane-1,3-diamine
CID 174522138
methyl prop-2-enoate;1,1,2-trimethoxy-2-propylsilinane
CID 175374557
but-1-ene;N-methylprop-2-enamide
CID 159446883

Frequently Asked Questions

What is the IUPAC name of N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane?
The IUPAC name of N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane (CID 174864706) is N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane.
What is the SMILES notation for N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane?
The canonical SMILES for N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane is C=CC(=O)NC.CCOC1(CC)CCCC[Si]1(OCC)OCC.
What is the InChIKey of N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane?
The InChIKey is MAHAPJKIYAAVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O3Si.C4H7NO/c1-5-13(14-6-2)11-9-10-12-17(13,15-7-3)16-8-4;1-3-4(6)5-2/h5-12H2,1-4H3;3H,1H2,2H3,(H,5,6).
What are the key properties of N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane?
N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane has a molecular weight of 345.56 g/mol, XLogP of 3.33, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane is sourced from PubChem (CID 174864706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).