N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide

C19H43NO7Si2 — CID 161444043

IUPACN-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide
SMILESCCN(CCC(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC)C(C)=O
InChIInChI=1S/C19H43NO7Si2/c1-9-20(18(2)21)15-14-19(12-10-16-28(22-3,23-4)24-5)13-11-17-29(25-6,26-7)27-8/h19H,9-17H2,1-8H3
InChIKeyQDWCFJCSKLRQTD-UHFFFAOYSA-N
MW453.73 g/mol
LogP3.18
Rot. Bonds18

About N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide

N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide (PubChem CID 161444043) has the molecular formula C19H43NO7Si2 and a molecular weight of 453.73 g/mol. Its IUPAC name is N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide.

Molecular Properties

Compound NameN-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide
PubChem CID161444043
Molecular FormulaC19H43NO7Si2
Molecular Weight453.73 g/mol
Exact Mass453.26
IUPAC NameN-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide
SMILESCCN(CCC(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC)C(C)=O
InChIInChI=1S/C19H43NO7Si2/c1-9-20(18(2)21)15-14-19(12-10-16-28(22-3,23-4)24-5)13-11-17-29(25-6,26-7)27-8/h19H,9-17H2,1-8H3
InChIKeyQDWCFJCSKLRQTD-UHFFFAOYSA-N
XLogP3.18
TPSA75.69 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds18
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.73
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N-[3-ethyl-6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide;N-ethyl-N-[3-methyl-6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide;N-ethyl-N-[7-trimethoxysilyl-3-(4-trimethoxysilylbutyl)heptyl]acetamide;N-ethyl-N-[7-trimethoxysilyl-3-(3-trimethoxysilylpropyl)heptyl]acetamide
CID 160773506
N,N-dimethyl-3-(3-trimethoxysilylpropyl)octadecan-1-amine;hydrochloride
CID 173004886
2-hydroxy-N,N-bis(3-trimethoxysilylpropyl)propanamide
CID 140720922
N-(2-aminoethyl)-N-ethylacetamide
CID 23084474
N-ethyl-N-propylacetamide;methane;propane
CID 161155898
N-[3-(diethylamino)propyl]-N-ethylacetamide
CID 102998319
2-bromo-N,N-bis(3-trimethoxysilylpropyl)acetamide
CID 168863060
4-[dimethoxy(methyl)silyl]butyl-ethylcarbamic acid
CID 87910081
3-sulfanyl-6-trimethoxysilylhexanoic acid
CID 142550334
N-methyl-N-(3-trimethoxysilylpropyl)propanamide
CID 87495957
3-(3-trimethoxysilylpropyl)-1,1-bis[2-(3-trimethoxysilylpropylcarbamoylamino)ethyl]urea
CID 20743189
[butyl(dimethoxy)silyl] 2-methylprop-2-enoate
CID 87481263

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide?
The IUPAC name of N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide (CID 161444043) is N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide.
What is the SMILES notation for N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide?
The canonical SMILES for N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide is CCN(CCC(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC)C(C)=O.
What is the InChIKey of N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide?
The InChIKey is QDWCFJCSKLRQTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H43NO7Si2/c1-9-20(18(2)21)15-14-19(12-10-16-28(22-3,23-4)24-5)13-11-17-29(25-6,26-7)27-8/h19H,9-17H2,1-8H3.
What are the key properties of N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide?
N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide has a molecular weight of 453.73 g/mol, XLogP of 3.18, 18 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[6-trimethoxysilyl-3-(3-trimethoxysilylpropyl)hexyl]acetamide is sourced from PubChem (CID 161444043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).