[diacetyloxy(methyl)silyl] 2-(diethylamino)acetate

C11H21NO6Si — CID 151074331

IUPAC[diacetyloxy(methyl)silyl] 2-(diethylamino)acetate
SMILESCCN(CC)CC(=O)O[Si](C)(OC(C)=O)OC(C)=O
InChIInChI=1S/C11H21NO6Si/c1-6-12(7-2)8-11(15)18-19(5,16-9(3)13)17-10(4)14/h6-8H2,1-5H3
InChIKeyMIUBRFYPKYNYDO-UHFFFAOYSA-N
MW291.38 g/mol
LogP0.57
Rot. Bonds7

About [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate

[diacetyloxy(methyl)silyl] 2-(diethylamino)acetate (PubChem CID 151074331) has the molecular formula C11H21NO6Si and a molecular weight of 291.38 g/mol. Its IUPAC name is [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate.

Molecular Properties

Compound Name[diacetyloxy(methyl)silyl] 2-(diethylamino)acetate
PubChem CID151074331
Molecular FormulaC11H21NO6Si
Molecular Weight291.38 g/mol
Exact Mass291.11
IUPAC Name[diacetyloxy(methyl)silyl] 2-(diethylamino)acetate
SMILESCCN(CC)CC(=O)O[Si](C)(OC(C)=O)OC(C)=O
InChIInChI=1S/C11H21NO6Si/c1-6-12(7-2)8-11(15)18-19(5,16-9(3)13)17-10(4)14/h6-8H2,1-5H3
InChIKeyMIUBRFYPKYNYDO-UHFFFAOYSA-N
XLogP0.57
TPSA82.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 50.57
H-Bond Donors ≤ 50
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 [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate?
The IUPAC name of [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate (CID 151074331) is [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate.
What is the SMILES notation for [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate?
The canonical SMILES for [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate is CCN(CC)CC(=O)O[Si](C)(OC(C)=O)OC(C)=O.
What is the InChIKey of [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate?
The InChIKey is MIUBRFYPKYNYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO6Si/c1-6-12(7-2)8-11(15)18-19(5,16-9(3)13)17-10(4)14/h6-8H2,1-5H3.
What are the key properties of [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate?
[diacetyloxy(methyl)silyl] 2-(diethylamino)acetate has a molecular weight of 291.38 g/mol, XLogP of 0.57, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [diacetyloxy(methyl)silyl] 2-(diethylamino)acetate is sourced from PubChem (CID 151074331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).