2-(3-trimethylsilylpropyl)cyclopentan-1-one

C11H22OSi — CID 10397850

IUPAC2-(3-trimethylsilylpropyl)cyclopentan-1-one
SMILESC[Si](C)(C)CCCC1CCCC1=O
InChIInChI=1S/C11H22OSi/c1-13(2,3)9-5-7-10-6-4-8-11(10)12/h10H,4-9H2,1-3H3
InChIKeyGMDOKPLWYVFBDX-UHFFFAOYSA-N
MW198.38 g/mol
LogP3.47
Rot. Bonds4

About 2-(3-trimethylsilylpropyl)cyclopentan-1-one

2-(3-trimethylsilylpropyl)cyclopentan-1-one (PubChem CID 10397850) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 2-(3-trimethylsilylpropyl)cyclopentan-1-one.

Molecular Properties

Compound Name2-(3-trimethylsilylpropyl)cyclopentan-1-one
PubChem CID10397850
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name2-(3-trimethylsilylpropyl)cyclopentan-1-one
SMILESC[Si](C)(C)CCCC1CCCC1=O
InChIInChI=1S/C11H22OSi/c1-13(2,3)9-5-7-10-6-4-8-11(10)12/h10H,4-9H2,1-3H3
InChIKeyGMDOKPLWYVFBDX-UHFFFAOYSA-N
XLogP3.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.47
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

2-Heptylcyclopentanone
CID 8710
2-Hexylcyclopentanone
CID 114454
2-Pentylcyclopentan-1-one
CID 20959
2-Octylcyclopentanone
CID 558662
Cyclopentanone, 2-butyl-
CID 102524
2-Iso-butylcyclopentanone
CID 12222032
3-(2-Methylpropyl)cyclopentan-1-one
CID 15146219
Cyclopentanone, 2-(3-methylbutyl)-
CID 50986563
3-(3-Methylbutyl)cyclopentan-1-one
CID 64521347
(3S)-3-octylcyclopentan-1-one
CID 12540968
(R,S)-2-Pentyl-cyclopentanone
CID 1715089
3-Butylcyclopentanone
CID 557889

Frequently Asked Questions

What is the IUPAC name of 2-(3-trimethylsilylpropyl)cyclopentan-1-one?
The IUPAC name of 2-(3-trimethylsilylpropyl)cyclopentan-1-one (CID 10397850) is 2-(3-trimethylsilylpropyl)cyclopentan-1-one.
What is the SMILES notation for 2-(3-trimethylsilylpropyl)cyclopentan-1-one?
The canonical SMILES for 2-(3-trimethylsilylpropyl)cyclopentan-1-one is C[Si](C)(C)CCCC1CCCC1=O.
What is the InChIKey of 2-(3-trimethylsilylpropyl)cyclopentan-1-one?
The InChIKey is GMDOKPLWYVFBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-13(2,3)9-5-7-10-6-4-8-11(10)12/h10H,4-9H2,1-3H3.
What are the key properties of 2-(3-trimethylsilylpropyl)cyclopentan-1-one?
2-(3-trimethylsilylpropyl)cyclopentan-1-one has a molecular weight of 198.38 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-trimethylsilylpropyl)cyclopentan-1-one is sourced from PubChem (CID 10397850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).