trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate

C12H25NO3Si2 — CID 553245

IUPACtrimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate
SMILESC=C(C)C(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H25NO3Si2/c1-10(2)12(15)13(17(3,4)5)9-11(14)16-18(6,7)8/h1,9H2,2-8H3
InChIKeyYKMHQCMEUPAOBM-UHFFFAOYSA-N
MW287.51 g/mol
LogP2.60
Rot. Bonds5

About trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate

trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate (PubChem CID 553245) has the molecular formula C12H25NO3Si2 and a molecular weight of 287.51 g/mol. Its IUPAC name is trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate.

Molecular Properties

Compound Nametrimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate
PubChem CID553245
Molecular FormulaC12H25NO3Si2
Molecular Weight287.51 g/mol
Exact Mass287.14
IUPAC Nametrimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate
SMILESC=C(C)C(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C12H25NO3Si2/c1-10(2)12(15)13(17(3,4)5)9-11(14)16-18(6,7)8/h1,9H2,2-8H3
InChIKeyYKMHQCMEUPAOBM-UHFFFAOYSA-N
XLogP2.60
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.51
LogP ≤ 52.60
H-Bond Donors ≤ 50
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-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate?
The IUPAC name of trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate (CID 553245) is trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate.
What is the SMILES notation for trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate?
The canonical SMILES for trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate is C=C(C)C(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate?
The InChIKey is YKMHQCMEUPAOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO3Si2/c1-10(2)12(15)13(17(3,4)5)9-11(14)16-18(6,7)8/h1,9H2,2-8H3.
What are the key properties of trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate?
trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate has a molecular weight of 287.51 g/mol, XLogP of 2.60, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-[2-methylprop-2-enoyl(trimethylsilyl)amino]acetate is sourced from PubChem (CID 553245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).