methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate

C15H29NO6Si3 — CID 91700235

IUPACmethyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate
SMILESCOC(=O)CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCc1cccnc1
InChIInChI=1S/C15H29NO6Si3/c1-18-15(17)13-20-24(4,5)22-25(6,7)21-23(2,3)19-12-14-9-8-10-16-11-14/h8-11H,12-13H2,1-7H3
InChIKeyOHAOALUIGKJLRU-UHFFFAOYSA-N
MW403.66 g/mol
LogP2.93
Rot. Bonds10

About methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate

methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate (PubChem CID 91700235) has the molecular formula C15H29NO6Si3 and a molecular weight of 403.66 g/mol. Its IUPAC name is methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate.

Molecular Properties

Compound Namemethyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate
PubChem CID91700235
Molecular FormulaC15H29NO6Si3
Molecular Weight403.66 g/mol
Exact Mass403.13
IUPAC Namemethyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate
SMILESCOC(=O)CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCc1cccnc1
InChIInChI=1S/C15H29NO6Si3/c1-18-15(17)13-20-24(4,5)22-25(6,7)21-23(2,3)19-12-14-9-8-10-16-11-14/h8-11H,12-13H2,1-7H3
InChIKeyOHAOALUIGKJLRU-UHFFFAOYSA-N
XLogP2.93
TPSA76.11 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.66
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate with MolForge

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Related Compounds

[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-(2-methoxyethoxy)-dimethylsilane
CID 91700183
2-(2-methoxyethoxy)ethoxy-dimethyl-(pyridin-3-ylmethoxy)silane
CID 91700003
trimethyl(pyridin-3-ylmethoxy)silane
CID 11063032
(111C)methyl 3-pyridin-3-ylpropanoate
CID 11816043
2-[2-(2-butoxyethoxy)ethoxy]ethoxy-[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilane
CID 91699999
propan-2-yl 2-(pyridin-3-ylmethoxy)acetate
CID 83214187
3,3-dimethyl-1-(pyridin-3-ylmethoxy)butan-2-one
CID 129255792
[dimethyl(octan-2-yloxy)silyl]oxy-dimethyl-(pyridin-3-ylmethoxy)silane
CID 91700248
decoxy-dimethyl-(pyridin-3-ylmethoxy)silane
CID 91700280
2,4-dimethyl-5-oxo-5-(pyridin-3-ylmethoxy)pentanoic acid
CID 70449179
methyl 3-[methyl(pyridin-3-ylmethyl)amino]-3-oxopropanoate
CID 115174424
methyl (Z)-2-ethyl-4-(pyridin-3-ylmethoxy)but-2-enoate
CID 83214559

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate?
The IUPAC name of methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate (CID 91700235) is methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate.
What is the SMILES notation for methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate?
The canonical SMILES for methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate is COC(=O)CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCc1cccnc1.
What is the InChIKey of methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate?
The InChIKey is OHAOALUIGKJLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO6Si3/c1-18-15(17)13-20-24(4,5)22-25(6,7)21-23(2,3)19-12-14-9-8-10-16-11-14/h8-11H,12-13H2,1-7H3.
What are the key properties of methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate?
methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate has a molecular weight of 403.66 g/mol, XLogP of 2.93, 10 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[[dimethyl(pyridin-3-ylmethoxy)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxyacetate is sourced from PubChem (CID 91700235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).