trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate

C15H37NO5Si3 — CID 88852136

IUPACtrimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate
SMILESCO[Si](CCCN(CCC(=O)O[Si](C)(C)C)[Si](C)(C)C)(OC)OC
InChIInChI=1S/C15H37NO5Si3/c1-18-24(19-2,20-3)14-10-12-16(22(4,5)6)13-11-15(17)21-23(7,8)9/h10-14H2,1-9H3
InChIKeyQYQNIUAWLKHUPT-UHFFFAOYSA-N
MW395.72 g/mol
LogP3.16
Rot. Bonds12

About trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate

trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate (PubChem CID 88852136) has the molecular formula C15H37NO5Si3 and a molecular weight of 395.72 g/mol. Its IUPAC name is trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate.

Molecular Properties

Compound Nametrimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate
PubChem CID88852136
Molecular FormulaC15H37NO5Si3
Molecular Weight395.72 g/mol
Exact Mass395.20
IUPAC Nametrimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate
SMILESCO[Si](CCCN(CCC(=O)O[Si](C)(C)C)[Si](C)(C)C)(OC)OC
InChIInChI=1S/C15H37NO5Si3/c1-18-24(19-2,20-3)14-10-12-16(22(4,5)6)13-11-15(17)21-23(7,8)9/h10-14H2,1-9H3
InChIKeyQYQNIUAWLKHUPT-UHFFFAOYSA-N
XLogP3.16
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.72
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

bis(trimethylsilyl) 2-[methyl(3-trimethoxysilylpropyl)amino]butanedioate
CID 88852299
triethylsilyl 3-[ethyl(3-trimethoxysilylpropyl)amino]propanoate
CID 88852370
bis(trimethylsilyl) (Z)-oct-4-enedioate
CID 91753100
trimethylsilyl 4-[bis(trimethylsilyl)amino]butanoate
CID 529208
[tert-butyl(dimethyl)silyl] 3-[ethyl(3-trimethoxysilylpropyl)amino]propanoate
CID 88852033
trimethylsilyl 6-[bis(trimethylsilyl)amino]hexanoate
CID 529226
ethyl 3-[(3-ethoxy-3-oxopropyl)-(3-trimethoxysilylpropyl)amino]propanoate
CID 170745110
N-(3-trimethoxysilylpropyl)-N-trimethylsilylmorpholine-4-carboxamide
CID 155926383
methyl(3-trimethoxysilylpropyl)carbamic acid
CID 71432003
(decyl-methoxy-octadecanoyloxysilyl) octadecanoate
CID 175034146
(hexyl-methoxy-octadecanoyloxysilyl) octadecanoate
CID 175034042
trimethylsilyl (E)-octadec-11-enoate
CID 5366419

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate?
The IUPAC name of trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate (CID 88852136) is trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate.
What is the SMILES notation for trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate?
The canonical SMILES for trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate is CO[Si](CCCN(CCC(=O)O[Si](C)(C)C)[Si](C)(C)C)(OC)OC.
What is the InChIKey of trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate?
The InChIKey is QYQNIUAWLKHUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H37NO5Si3/c1-18-24(19-2,20-3)14-10-12-16(22(4,5)6)13-11-15(17)21-23(7,8)9/h10-14H2,1-9H3.
What are the key properties of trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate?
trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate has a molecular weight of 395.72 g/mol, XLogP of 3.16, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 3-[3-trimethoxysilylpropyl(trimethylsilyl)amino]propanoate is sourced from PubChem (CID 88852136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).