N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide

C13H27NO2Si — CID 135017412

IUPACN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide
SMILESC=CCN(CCO[Si](C)(C)C(C)(C)C)C(C)=O
InChIInChI=1S/C13H27NO2Si/c1-8-9-14(12(2)15)10-11-16-17(6,7)13(3,4)5/h8H,1,9-11H2,2-7H3
InChIKeyBJIMMHBLFLZDHP-UHFFFAOYSA-N
MW257.45 g/mol
LogP3.04
Rot. Bonds6

About N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide

N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide (PubChem CID 135017412) has the molecular formula C13H27NO2Si and a molecular weight of 257.45 g/mol. Its IUPAC name is N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide.

Molecular Properties

Compound NameN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide
PubChem CID135017412
Molecular FormulaC13H27NO2Si
Molecular Weight257.45 g/mol
Exact Mass257.18
IUPAC NameN-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide
SMILESC=CCN(CCO[Si](C)(C)C(C)(C)C)C(C)=O
InChIInChI=1S/C13H27NO2Si/c1-8-9-14(12(2)15)10-11-16-17(6,7)13(3,4)5/h8H,1,9-11H2,2-7H3
InChIKeyBJIMMHBLFLZDHP-UHFFFAOYSA-N
XLogP3.04
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.45
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide?
The IUPAC name of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide (CID 135017412) is N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide.
What is the SMILES notation for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide?
The canonical SMILES for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide is C=CCN(CCO[Si](C)(C)C(C)(C)C)C(C)=O.
What is the InChIKey of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide?
The InChIKey is BJIMMHBLFLZDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2Si/c1-8-9-14(12(2)15)10-11-16-17(6,7)13(3,4)5/h8H,1,9-11H2,2-7H3.
What are the key properties of N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide?
N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide has a molecular weight of 257.45 g/mol, XLogP of 3.04, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N-prop-2-enylacetamide is sourced from PubChem (CID 135017412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).