[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate

C19H43NO4Si2 — CID 88852109

IUPAC[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate
SMILESCCO[Si](C)(CCCN(CC)CCC(=O)O[Si](C)(C)C(C)(C)C)OCC
InChIInChI=1S/C19H43NO4Si2/c1-10-20(15-13-17-26(9,22-11-2)23-12-3)16-14-18(21)24-25(7,8)19(4,5)6/h10-17H2,1-9H3
InChIKeyCAFQSMLAKAYPSW-UHFFFAOYSA-N
MW405.73 g/mol
LogP4.78
Rot. Bonds13

About [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate

[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate (PubChem CID 88852109) has the molecular formula C19H43NO4Si2 and a molecular weight of 405.73 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate
PubChem CID88852109
Molecular FormulaC19H43NO4Si2
Molecular Weight405.73 g/mol
Exact Mass405.27
IUPAC Name[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate
SMILESCCO[Si](C)(CCCN(CC)CCC(=O)O[Si](C)(C)C(C)(C)C)OCC
InChIInChI=1S/C19H43NO4Si2/c1-10-20(15-13-17-26(9,22-11-2)23-12-3)16-14-18(21)24-25(7,8)19(4,5)6/h10-17H2,1-9H3
InChIKeyCAFQSMLAKAYPSW-UHFFFAOYSA-N
XLogP4.78
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.73
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-methylamino]propanoate
CID 88852298
triethylsilyl 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate
CID 88852037
[tert-butyl(dimethyl)silyl] 3-[ethyl-[3-[methoxy(dimethyl)silyl]propyl]amino]propanoate
CID 88852191
[tert-butyl(dimethyl)silyl] 3-[ethyl(3-trimethoxysilylpropyl)amino]propanoate
CID 88852033
[tert-butyl(dimethyl)silyl] 3-[3-[ethoxy(dimethyl)silyl]propyl-methylamino]propanoate
CID 88852155
N'-[3-[diethoxy(methyl)silyl]propyl]-N'-[3-(diethylamino)propyl]-N,N-diethylpropane-1,3-diamine
CID 140647314
bis[tert-butyl(dimethyl)silyl] hexanedioate
CID 528567
triethylsilyl 3-[ethyl(3-trimethoxysilylpropyl)amino]propanoate
CID 88852370
triethylsilyl 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]-2-methylpropanoate
CID 88852273
3-[[3-(diethylamino)propyl-[3-(diethylamino)propyl-[3-(diethylamino)propyl-[3-(diethylamino)propyl-[3-(diethylamino)propyl-ethoxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-methylsilyl]oxy-ethoxy-methylsilyl]-N,N-diethylpropan-1-amine
CID 171623497
[tert-butyl(dimethyl)silyl] tetradecanoate
CID 528599
[tert-butyl(dimethyl)silyl] heptacosanoate
CID 91752633

Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate?
The IUPAC name of [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate (CID 88852109) is [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate is CCO[Si](C)(CCCN(CC)CCC(=O)O[Si](C)(C)C(C)(C)C)OCC.
What is the InChIKey of [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate?
The InChIKey is CAFQSMLAKAYPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H43NO4Si2/c1-10-20(15-13-17-26(9,22-11-2)23-12-3)16-14-18(21)24-25(7,8)19(4,5)6/h10-17H2,1-9H3.
What are the key properties of [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate?
[tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate has a molecular weight of 405.73 g/mol, XLogP of 4.78, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] 3-[3-[diethoxy(methyl)silyl]propyl-ethylamino]propanoate is sourced from PubChem (CID 88852109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).