3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol

C14H37NO6Si2 — CID 88537820

IUPAC3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol
SMILESCCO[Si](C)(CCCN)OCC.CO[Si](CCCO)(OC)OC
InChIInChI=1S/C8H21NO2Si.C6H16O4Si/c1-4-10-12(3,11-5-2)8-6-7-9;1-8-11(9-2,10-3)6-4-5-7/h4-9H2,1-3H3;7H,4-6H2,1-3H3
InChIKeyYGOKZITVLJQMCJ-UHFFFAOYSA-N
MW371.62 g/mol
LogP1.73
Rot. Bonds13

About 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol

3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol (PubChem CID 88537820) has the molecular formula C14H37NO6Si2 and a molecular weight of 371.62 g/mol. Its IUPAC name is 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol.

Molecular Properties

Compound Name3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol
PubChem CID88537820
Molecular FormulaC14H37NO6Si2
Molecular Weight371.62 g/mol
Exact Mass371.22
IUPAC Name3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol
SMILESCCO[Si](C)(CCCN)OCC.CO[Si](CCCO)(OC)OC
InChIInChI=1S/C8H21NO2Si.C6H16O4Si/c1-4-10-12(3,11-5-2)8-6-7-9;1-8-11(9-2,10-3)6-4-5-7/h4-9H2,1-3H3;7H,4-6H2,1-3H3
InChIKeyYGOKZITVLJQMCJ-UHFFFAOYSA-N
XLogP1.73
TPSA92.40 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.62
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol?
The IUPAC name of 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol (CID 88537820) is 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol.
What is the SMILES notation for 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol?
The canonical SMILES for 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol is CCO[Si](C)(CCCN)OCC.CO[Si](CCCO)(OC)OC.
What is the InChIKey of 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol?
The InChIKey is YGOKZITVLJQMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21NO2Si.C6H16O4Si/c1-4-10-12(3,11-5-2)8-6-7-9;1-8-11(9-2,10-3)6-4-5-7/h4-9H2,1-3H3;7H,4-6H2,1-3H3.
What are the key properties of 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol?
3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol has a molecular weight of 371.62 g/mol, XLogP of 1.73, 13 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[diethoxy(methyl)silyl]propan-1-amine;3-trimethoxysilylpropan-1-ol is sourced from PubChem (CID 88537820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).