2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one

C11H22OSi — CID 12700722

IUPAC2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one
SMILESCC(C)(C)[Si](C)(C)C1CCCC1=O
InChIInChI=1S/C11H22OSi/c1-11(2,3)13(4,5)10-8-6-7-9(10)12/h10H,6-8H2,1-5H3
InChIKeyFLBHQTOEDINEOI-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.62
Rot. Bonds1

About 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one

2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one (PubChem CID 12700722) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one
PubChem CID12700722
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one
SMILESCC(C)(C)[Si](C)(C)C1CCCC1=O
InChIInChI=1S/C11H22OSi/c1-11(2,3)13(4,5)10-8-6-7-9(10)12/h10H,6-8H2,1-5H3
InChIKeyFLBHQTOEDINEOI-UHFFFAOYSA-N
XLogP3.62
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-Trimethylsilylcyclopentan-1-one
CID 14001618
1-Trimethylsilylpentan-2-one
CID 12457306
2-[Tert-butyl(dimethyl)silyl]pentan-3-one
CID 13775509
2-[Tert-butyl(dimethyl)silyl]hexan-3-one
CID 15033613
5-(Trimethylsilyl)-2-pentanone
CID 575386
6-Trimethylsilylhexan-2-one
CID 10080847
Silane, (1,1-dimethylethyl)dimethyl(1-oxopentyl)-
CID 11672873
(2R)-2-[tert-butyl(dimethyl)silyl]pentan-3-one
CID 11745677
(2S)-2-[tert-butyl(dimethyl)silyl]pentan-3-one
CID 13775510
(3S)-3-trimethylsilylcyclopentan-1-one
CID 14001619
1-(Triethylsilyl)hexan-2-one
CID 15033604
1-[Tert-butyl(dimethyl)silyl]hexan-2-one
CID 15033607

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one (CID 12700722) is 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one is CC(C)(C)[Si](C)(C)C1CCCC1=O.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one?
The InChIKey is FLBHQTOEDINEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-11(2,3)13(4,5)10-8-6-7-9(10)12/h10H,6-8H2,1-5H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one?
2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one has a molecular weight of 198.38 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]cyclopentan-1-one is sourced from PubChem (CID 12700722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).