[hydroxymethyl(3-triethoxysilylpropyl)amino]methanol

C11H27NO5Si — CID 21325287

IUPAC[hydroxymethyl(3-triethoxysilylpropyl)amino]methanol
SMILESCCO[Si](CCCN(CO)CO)(OCC)OCC
InChIInChI=1S/C11H27NO5Si/c1-4-15-18(16-5-2,17-6-3)9-7-8-12(10-13)11-14/h13-14H,4-11H2,1-3H3
InChIKeyAWDKMRYABDZFSM-UHFFFAOYSA-N
MW281.42 g/mol
LogP0.63
Rot. Bonds12

About [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol

[hydroxymethyl(3-triethoxysilylpropyl)amino]methanol (PubChem CID 21325287) has the molecular formula C11H27NO5Si and a molecular weight of 281.42 g/mol. Its IUPAC name is [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol.

Molecular Properties

Compound Name[hydroxymethyl(3-triethoxysilylpropyl)amino]methanol
PubChem CID21325287
Molecular FormulaC11H27NO5Si
Molecular Weight281.42 g/mol
Exact Mass281.17
IUPAC Name[hydroxymethyl(3-triethoxysilylpropyl)amino]methanol
SMILESCCO[Si](CCCN(CO)CO)(OCC)OCC
InChIInChI=1S/C11H27NO5Si/c1-4-15-18(16-5-2,17-6-3)9-7-8-12(10-13)11-14/h13-14H,4-11H2,1-3H3
InChIKeyAWDKMRYABDZFSM-UHFFFAOYSA-N
XLogP0.63
TPSA71.39 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol?
The IUPAC name of [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol (CID 21325287) is [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol.
What is the SMILES notation for [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol?
The canonical SMILES for [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol is CCO[Si](CCCN(CO)CO)(OCC)OCC.
What is the InChIKey of [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol?
The InChIKey is AWDKMRYABDZFSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO5Si/c1-4-15-18(16-5-2,17-6-3)9-7-8-12(10-13)11-14/h13-14H,4-11H2,1-3H3.
What are the key properties of [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol?
[hydroxymethyl(3-triethoxysilylpropyl)amino]methanol has a molecular weight of 281.42 g/mol, XLogP of 0.63, 12 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [hydroxymethyl(3-triethoxysilylpropyl)amino]methanol is sourced from PubChem (CID 21325287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).