3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine

C14H33NO7Si — CID 173058176

IUPAC3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine
SMILESCOC(C)OCC(O[SiH2]CCCN)(OC(C)OC)OC(C)OC
InChIInChI=1S/C14H33NO7Si/c1-11(16-4)19-10-14(20-12(2)17-5,21-13(3)18-6)22-23-9-7-8-15/h11-13H,7-10,15,23H2,1-6H3
InChIKeySNJIVZHLWSHGIT-UHFFFAOYSA-N
MW355.50 g/mol
LogP0.53
Rot. Bonds15

About 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine

3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine (PubChem CID 173058176) has the molecular formula C14H33NO7Si and a molecular weight of 355.50 g/mol. Its IUPAC name is 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine.

Molecular Properties

Compound Name3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine
PubChem CID173058176
Molecular FormulaC14H33NO7Si
Molecular Weight355.50 g/mol
Exact Mass355.20
IUPAC Name3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine
SMILESCOC(C)OCC(O[SiH2]CCCN)(OC(C)OC)OC(C)OC
InChIInChI=1S/C14H33NO7Si/c1-11(16-4)19-10-14(20-12(2)17-5,21-13(3)18-6)22-23-9-7-8-15/h11-13H,7-10,15,23H2,1-6H3
InChIKeySNJIVZHLWSHGIT-UHFFFAOYSA-N
XLogP0.53
TPSA90.63 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.50
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(1-methoxyethoxymethylsilyl)ethanamine
CID 174967226
1,1,1-trifluoro-2-(1-methoxyethoxy)ethane
CID 87508044
2-[1-(1-methoxyethoxy)ethylsilyl]ethanamine
CID 174967229
1,4-bis(1-methoxyethoxy)butane
CID 20578725
3-[tris(1-methoxyethoxy)silyl]propan-1-amine
CID 18398211
2-(1-methoxyethoxy)butan-2-amine
CID 155164738
4-(3-methoxy-3-methylbutoxy)pentan-1-amine
CID 106667811
3-[2-(1-methoxypropoxy)ethylsilyl]propan-1-amine
CID 174968471
3-(2,5-dimethylhexan-3-yloxysilyl)propan-1-amine
CID 123748484
3-silyloxysilyloxysilyloxysilyloxysilyloxysilyloxysilyloxysilyloxysilyloxysilylpropan-1-amine
CID 175991453
3-(methylaminosilyl)propan-1-amine
CID 150093029
1,1-dimethoxyethane;1-ethoxy-1-methoxyethane
CID 175467857

Frequently Asked Questions

What is the IUPAC name of 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine?
The IUPAC name of 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine (CID 173058176) is 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine.
What is the SMILES notation for 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine?
The canonical SMILES for 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine is COC(C)OCC(O[SiH2]CCCN)(OC(C)OC)OC(C)OC.
What is the InChIKey of 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine?
The InChIKey is SNJIVZHLWSHGIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H33NO7Si/c1-11(16-4)19-10-14(20-12(2)17-5,21-13(3)18-6)22-23-9-7-8-15/h11-13H,7-10,15,23H2,1-6H3.
What are the key properties of 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine?
3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine has a molecular weight of 355.50 g/mol, XLogP of 0.53, 15 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1,1,2-tris(1-methoxyethoxy)ethoxysilyl]propan-1-amine is sourced from PubChem (CID 173058176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).