3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one

C13H24O2Si — CID 11184065

IUPAC3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one
SMILESC[C@@H](O[Si](C)(C)C(C)(C)C)C1=CC(=O)CC1
InChIInChI=1S/C13H24O2Si/c1-10(11-7-8-12(14)9-11)15-16(5,6)13(2,3)4/h9-10H,7-8H2,1-6H3/t10-/m1/s1
InChIKeyJHVUFZMBHDZVSY-SNVBAGLBSA-N
MW240.42 g/mol
LogP3.69
Rot. Bonds3

About 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one

3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one (PubChem CID 11184065) has the molecular formula C13H24O2Si and a molecular weight of 240.42 g/mol. Its IUPAC name is 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one.

Molecular Properties

Compound Name3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one
PubChem CID11184065
Molecular FormulaC13H24O2Si
Molecular Weight240.42 g/mol
Exact Mass240.15
IUPAC Name3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one
SMILESC[C@@H](O[Si](C)(C)C(C)(C)C)C1=CC(=O)CC1
InChIInChI=1S/C13H24O2Si/c1-10(11-7-8-12(14)9-11)15-16(5,6)13(2,3)4/h9-10H,7-8H2,1-6H3/t10-/m1/s1
InChIKeyJHVUFZMBHDZVSY-SNVBAGLBSA-N
XLogP3.69
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(((Tert-butyldimethylsilyl)oxy)methyl)-2-cyclopentenone
CID 13161571
3-[[(Tert-butyldimethylsilyl)oxy]methyl]-2-cyclopentenone
CID 15649271
3-[2-[Tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one
CID 15649272
(4S)-4-[tert-butyl(dimethyl)silyl]oxy-3-methylcyclohex-2-en-1-one
CID 12666238
4-((tert-Butyldimethylsilyl)oxy)-3-methylcyclohex-2-en-1-one
CID 12666239
4-[Tert-butyl(dimethyl)silyl]oxy-3-methylcyclopent-2-en-1-one
CID 134963516
3-Ethyl-4-triethylsilyloxycyclohex-2-en-1-one
CID 134966340
(4S,5S)-4-[tert-butyl(dimethyl)silyl]oxy-5-methyl-3-prop-2-enylcyclohept-2-en-1-one
CID 134967159
3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyoct-1-enyl]-2-methylcyclopent-2-en-1-one
CID 10427154
4-[Tert-butyl(dimethyl)silyl]oxy-2-methylcyclopent-2-en-1-one
CID 10987962
3-Butyl-4-[tert-butyl(dimethyl)silyl]oxycyclopent-2-en-1-one
CID 12653997
(RS)-3-allyl-4-oxo-2-cyclopenten-1-yl (t-butyldimethylsilyl) ether
CID 14189022

Frequently Asked Questions

What is the IUPAC name of 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one?
The IUPAC name of 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one (CID 11184065) is 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one.
What is the SMILES notation for 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one?
The canonical SMILES for 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one is C[C@@H](O[Si](C)(C)C(C)(C)C)C1=CC(=O)CC1.
What is the InChIKey of 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one?
The InChIKey is JHVUFZMBHDZVSY-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H24O2Si/c1-10(11-7-8-12(14)9-11)15-16(5,6)13(2,3)4/h9-10H,7-8H2,1-6H3/t10-/m1/s1.
What are the key properties of 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one?
3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one has a molecular weight of 240.42 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]cyclopent-2-en-1-one is sourced from PubChem (CID 11184065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).