3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide

C15H25NO3Si — CID 20610043

IUPAC3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1cccc(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C15H25NO3Si/c1-15(2,3)20(6,7)19-13-10-8-9-12(11-13)14(17)16(4)18-5/h8-11H,1-7H3
InChIKeyTZXMYYTYGFOETL-UHFFFAOYSA-N
MW295.46 g/mol
LogP3.70
Rot. Bonds4

About 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide

3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide (PubChem CID 20610043) has the molecular formula C15H25NO3Si and a molecular weight of 295.46 g/mol. Its IUPAC name is 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide
PubChem CID20610043
Molecular FormulaC15H25NO3Si
Molecular Weight295.46 g/mol
Exact Mass295.16
IUPAC Name3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide
SMILESCON(C)C(=O)c1cccc(O[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C15H25NO3Si/c1-15(2,3)20(6,7)19-13-10-8-9-12(11-13)14(17)16(4)18-5/h8-11H,1-7H3
InChIKeyTZXMYYTYGFOETL-UHFFFAOYSA-N
XLogP3.70
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.46
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide?
The IUPAC name of 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide (CID 20610043) is 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide.
What is the SMILES notation for 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide?
The canonical SMILES for 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide is CON(C)C(=O)c1cccc(O[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide?
The InChIKey is TZXMYYTYGFOETL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3Si/c1-15(2,3)20(6,7)19-13-10-8-9-12(11-13)14(17)16(4)18-5/h8-11H,1-7H3.
What are the key properties of 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide?
3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide has a molecular weight of 295.46 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N-methylbenzamide is sourced from PubChem (CID 20610043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).