ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate

C27H71NO26Si8 — CID 167678976

IUPACethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate
SMILESCCOC(=O)N(CCC[Si](O[Si](OC)(OC)OC)(O[Si](OC)(OC)OC)O[Si](OC)(OC)OC)CCC[Si](O[Si](OC)(OC)OC)(O[Si](OC)(OC)OC)O[Si](OC)(OC)OC
InChIInChI=1S/C27H71NO26Si8/c1-20-48-27(29)28(23-21-25-55(49-57(30-2,31-3)32-4,50-58(33-5,34-6)35-7)51-59(36-8,37-9)38-10)24-22-26-56(52-60(39-11,40-12)41-13,53-61(42-14,43-15)44-16)54-62(45-17,46-18)47-19/h20-26H2,1-19H3
InChIKeyFNDYWGOWPUHJOZ-UHFFFAOYSA-N
MW1050.53 g/mol
LogP0.45
Rot. Bonds39

About ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate

ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate (PubChem CID 167678976) has the molecular formula C27H71NO26Si8 and a molecular weight of 1050.53 g/mol. Its IUPAC name is ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate.

Molecular Properties

Compound Nameethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate
PubChem CID167678976
Molecular FormulaC27H71NO26Si8
Molecular Weight1050.53 g/mol
Exact Mass1049.24
IUPAC Nameethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate
SMILESCCOC(=O)N(CCC[Si](O[Si](OC)(OC)OC)(O[Si](OC)(OC)OC)O[Si](OC)(OC)OC)CCC[Si](O[Si](OC)(OC)OC)(O[Si](OC)(OC)OC)O[Si](OC)(OC)OC
InChIInChI=1S/C27H71NO26Si8/c1-20-48-27(29)28(23-21-25-55(49-57(30-2,31-3)32-4,50-58(33-5,34-6)35-7)51-59(36-8,37-9)38-10)24-22-26-56(52-60(39-11,40-12)41-13,53-61(42-14,43-15)44-16)54-62(45-17,46-18)47-19/h20-26H2,1-19H3
InChIKeyFNDYWGOWPUHJOZ-UHFFFAOYSA-N
XLogP0.45
TPSA251.06 Ų
H-Bond Donors
H-Bond Acceptors26
Rotatable Bonds39
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001050.53
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

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

Analyze ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate 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

ethyl N,N-didodecylcarbamate
CID 70629624
ethyl N-[6-[ethoxycarbonyl(octyl)amino]hexyl]-N-octylcarbamate
CID 23053337
ethyl N,N-di(heptadecyl)carbamate
CID 70629745
2-bromo-N,N-bis(3-trimethoxysilylpropyl)acetamide
CID 168863060
ethyl N-[3-(oxiran-2-ylmethoxy)propyl]-N-(3-triethoxysilylpropyl)carbamate
CID 87376447
methyl N-[3-tris(trimethoxysilyloxy)silylpropyl]carbamate
CID 22065649
ethyl 3-[(3-ethoxy-3-oxopropyl)-(3-trimethoxysilylpropyl)amino]propanoate
CID 170745110
ethyl N-heptyl-N-(3-hydroxypropyl)carbamate
CID 64593193
ethyl N-[2-[ethoxycarbonyl(ethyl)amino]ethyl]-N-ethylcarbamate
CID 11777393
ethyl N,N-didodecylcarbamate;hexa-2,4-diyne-1,6-diol
CID 163902073
N-methyl-N-(3-trimethoxysilylpropyl)propanamide
CID 87495957
methyl 3-[3-(2-aminoethoxy)propyl-ethoxycarbonylamino]propanoate
CID 134542602

Frequently Asked Questions

What is the IUPAC name of ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate?
The IUPAC name of ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate (CID 167678976) is ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate.
What is the SMILES notation for ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate?
The canonical SMILES for ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate is CCOC(=O)N(CCC[Si](O[Si](OC)(OC)OC)(O[Si](OC)(OC)OC)O[Si](OC)(OC)OC)CCC[Si](O[Si](OC)(OC)OC)(O[Si](OC)(OC)OC)O[Si](OC)(OC)OC.
What is the InChIKey of ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate?
The InChIKey is FNDYWGOWPUHJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H71NO26Si8/c1-20-48-27(29)28(23-21-25-55(49-57(30-2,31-3)32-4,50-58(33-5,34-6)35-7)51-59(36-8,37-9)38-10)24-22-26-56(52-60(39-11,40-12)41-13,53-61(42-14,43-15)44-16)54-62(45-17,46-18)47-19/h20-26H2,1-19H3.
What are the key properties of ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate?
ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate has a molecular weight of 1050.53 g/mol, XLogP of 0.45, 39 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N,N-bis[3-tris(trimethoxysilyloxy)silylpropyl]carbamate is sourced from PubChem (CID 167678976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).