2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate

C13H29NO5Si — CID 59782863

IUPAC2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate
SMILESCOCCOC(=O)C(C)CNCCC[Si](C)(OC)OC
InChIInChI=1S/C13H29NO5Si/c1-12(13(15)19-9-8-16-2)11-14-7-6-10-20(5,17-3)18-4/h12,14H,6-11H2,1-5H3
InChIKeyCCZYBYYDOMGIOO-UHFFFAOYSA-N
MW307.46 g/mol
LogP1.16
Rot. Bonds12

About 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate

2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate (PubChem CID 59782863) has the molecular formula C13H29NO5Si and a molecular weight of 307.46 g/mol. Its IUPAC name is 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate.

Molecular Properties

Compound Name2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate
PubChem CID59782863
Molecular FormulaC13H29NO5Si
Molecular Weight307.46 g/mol
Exact Mass307.18
IUPAC Name2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate
SMILESCOCCOC(=O)C(C)CNCCC[Si](C)(OC)OC
InChIInChI=1S/C13H29NO5Si/c1-12(13(15)19-9-8-16-2)11-14-7-6-10-20(5,17-3)18-4/h12,14H,6-11H2,1-5H3
InChIKeyCCZYBYYDOMGIOO-UHFFFAOYSA-N
XLogP1.16
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.46
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-propoxyethoxy)ethoxy]ethyl 2-methyl-3-(3-trimethoxysilylpropylamino)propanoate
CID 58122243
2-[3-[3-[dimethoxy(methyl)silyl]propylsulfanyl]-2-methylpropanoyl]oxyethyl 3-[3-[dimethoxy(methyl)silyl]propylsulfanyl]-2-methylpropanoate
CID 59305886
tri(propan-2-yl)silyl 3-[3-[methoxy(dimethyl)silyl]propylamino]-2-methylpropanoate
CID 88852245
tri(propan-2-yl)silyl 3-[3-[diethoxy(methyl)silyl]propylamino]-2-methylpropanoate
CID 88852346
N-[3-[dimethoxy(methyl)silyl]propyl]-3-propan-2-yloxypropan-1-amine
CID 142737697
2-dodecoxyethyl 2-methyl-3-(3-triethoxysilylpropylamino)propanoate
CID 59782817
1-N-[3-[dimethoxy(methyl)silyl]propyl]butane-1,2,4-triamine
CID 141486440
2-[3-[dimethoxy(methyl)silyl]propylamino]ethanol
CID 23089047
3-[3-[dimethoxy(methyl)silyl]propylamino]propan-1-ol
CID 150629317
decyl 3-(2-aminoethylamino)-2-methylpropanoate
CID 20551178
ethyl 3-(2-aminoethylamino)-2-methylpropanoate
CID 20551192
methyl 2-methyl-3-(5-methylhexylamino)propanoate
CID 115325726

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate?
The IUPAC name of 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate (CID 59782863) is 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate.
What is the SMILES notation for 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate?
The canonical SMILES for 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate is COCCOC(=O)C(C)CNCCC[Si](C)(OC)OC.
What is the InChIKey of 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate?
The InChIKey is CCZYBYYDOMGIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO5Si/c1-12(13(15)19-9-8-16-2)11-14-7-6-10-20(5,17-3)18-4/h12,14H,6-11H2,1-5H3.
What are the key properties of 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate?
2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate has a molecular weight of 307.46 g/mol, XLogP of 1.16, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl 3-[3-[dimethoxy(methyl)silyl]propylamino]-2-methylpropanoate is sourced from PubChem (CID 59782863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).