ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate

C14H24O3Si — CID 15083415

IUPACethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate
SMILESCCOC(=O)C1(C/C=C/[Si](C)(C)C)CCCC1=O
InChIInChI=1S/C14H24O3Si/c1-5-17-13(16)14(9-6-8-12(14)15)10-7-11-18(2,3)4/h7,11H,5-6,8-10H2,1-4H3/b11-7+
InChIKeyMUTVQGLRZIPGPP-YRNVUSSQSA-N
MW268.43 g/mol
LogP3.11
Rot. Bonds5

About ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate

ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate (PubChem CID 15083415) has the molecular formula C14H24O3Si and a molecular weight of 268.43 g/mol. Its IUPAC name is ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate.

Molecular Properties

Compound Nameethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate
PubChem CID15083415
Molecular FormulaC14H24O3Si
Molecular Weight268.43 g/mol
Exact Mass268.15
IUPAC Nameethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate
SMILESCCOC(=O)C1(C/C=C/[Si](C)(C)C)CCCC1=O
InChIInChI=1S/C14H24O3Si/c1-5-17-13(16)14(9-6-8-12(14)15)10-7-11-18(2,3)4/h7,11H,5-6,8-10H2,1-4H3/b11-7+
InChIKeyMUTVQGLRZIPGPP-YRNVUSSQSA-N
XLogP3.11
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Methyl 1-allyl-2-oxocyclopentane-1-carboxylate
CID 10081040
2-Carbethoxy-2-allylcyclopentanone
CID 10910452
ethyl 1-[(E)-hept-2-enyl]-2-oxocyclopentane-1-carboxylate
CID 14168350
Ethyl 1-but-3-enyl-2-oxocyclopentane-1-carboxylate
CID 11218061
ethyl (1R)-2-oxo-1-prop-2-enylcyclopentane-1-carboxylate
CID 12320191
Ethyl 1-hex-2-enyl-2-oxocyclopentane-1-carboxylate
CID 134855551
Prop-2-enyl 2-oxo-1-prop-2-enylcyclopentane-1-carboxylate
CID 67742459
ethyl 2-oxo-1-[(Z)-2-tributylstannyl-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate
CID 15083410
methyl (1R)-2-oxo-1-prop-2-enylcyclopentane-1-carboxylate
CID 102266944
ethyl (1R)-2-methylidene-1-pent-4-enoylcyclopentane-1-carboxylate
CID 134848156
ethyl (1R)-1-(2-methylprop-2-enyl)-2-oxocyclopentane-1-carboxylate
CID 134961089
ethyl (1R)-1-[(E)-but-2-enyl]-2-oxocyclopentane-1-carboxylate
CID 134969448

Frequently Asked Questions

What is the IUPAC name of ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate?
The IUPAC name of ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate (CID 15083415) is ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate.
What is the SMILES notation for ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate?
The canonical SMILES for ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate is CCOC(=O)C1(C/C=C/[Si](C)(C)C)CCCC1=O.
What is the InChIKey of ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate?
The InChIKey is MUTVQGLRZIPGPP-YRNVUSSQSA-N. The full InChI is InChI=1S/C14H24O3Si/c1-5-17-13(16)14(9-6-8-12(14)15)10-7-11-18(2,3)4/h7,11H,5-6,8-10H2,1-4H3/b11-7+.
What are the key properties of ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate?
ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate has a molecular weight of 268.43 g/mol, XLogP of 3.11, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-oxo-1-[(E)-3-trimethylsilylprop-2-enyl]cyclopentane-1-carboxylate is sourced from PubChem (CID 15083415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).