trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate

C10H19NO3Si — CID 5367789

IUPACtrimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate
SMILESC/C=C(\C)C(=O)NCC(=O)O[Si](C)(C)C
InChIInChI=1S/C10H19NO3Si/c1-6-8(2)10(13)11-7-9(12)14-15(3,4)5/h6H,7H2,1-5H3,(H,11,13)/b8-6+
InChIKeyACEZAZFSJHWIDP-SOFGYWHQSA-N
MW229.35 g/mol
LogP1.45
Rot. Bonds4

About trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate

trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate (PubChem CID 5367789) has the molecular formula C10H19NO3Si and a molecular weight of 229.35 g/mol. Its IUPAC name is trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate.

Molecular Properties

Compound Nametrimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate
PubChem CID5367789
Molecular FormulaC10H19NO3Si
Molecular Weight229.35 g/mol
Exact Mass229.11
IUPAC Nametrimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate
SMILESC/C=C(\C)C(=O)NCC(=O)O[Si](C)(C)C
InChIInChI=1S/C10H19NO3Si/c1-6-8(2)10(13)11-7-9(12)14-15(3,4)5/h6H,7H2,1-5H3,(H,11,13)/b8-6+
InChIKeyACEZAZFSJHWIDP-SOFGYWHQSA-N
XLogP1.45
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate?
The IUPAC name of trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate (CID 5367789) is trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate.
What is the SMILES notation for trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate?
The canonical SMILES for trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate is C/C=C(\C)C(=O)NCC(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate?
The InChIKey is ACEZAZFSJHWIDP-SOFGYWHQSA-N. The full InChI is InChI=1S/C10H19NO3Si/c1-6-8(2)10(13)11-7-9(12)14-15(3,4)5/h6H,7H2,1-5H3,(H,11,13)/b8-6+.
What are the key properties of trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate?
trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate has a molecular weight of 229.35 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-[[(E)-2-methylbut-2-enoyl]amino]acetate is sourced from PubChem (CID 5367789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).