(3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one

C18H20OSi — CID 11129707

IUPAC(3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one
SMILESC[Si](c1ccccc1)(c1ccccc1)[C@H]1CCC(=O)C1
InChIInChI=1S/C18H20OSi/c1-20(16-8-4-2-5-9-16,17-10-6-3-7-11-17)18-13-12-15(19)14-18/h2-11,18H,12-14H2,1H3/t18-/m0/s1
InChIKeyNMRVSSZYDLOGFF-SFHVURJKSA-N
MW280.44 g/mol
LogP3.00
Rot. Bonds3

About (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one

(3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one (PubChem CID 11129707) has the molecular formula C18H20OSi and a molecular weight of 280.44 g/mol. Its IUPAC name is (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one.

Molecular Properties

Compound Name(3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one
PubChem CID11129707
Molecular FormulaC18H20OSi
Molecular Weight280.44 g/mol
Exact Mass280.13
IUPAC Name(3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one
SMILESC[Si](c1ccccc1)(c1ccccc1)[C@H]1CCC(=O)C1
InChIInChI=1S/C18H20OSi/c1-20(16-8-4-2-5-9-16,17-10-6-3-7-11-17)18-13-12-15(19)14-18/h2-11,18H,12-14H2,1H3/t18-/m0/s1
InChIKeyNMRVSSZYDLOGFF-SFHVURJKSA-N
XLogP3.00
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one?
The IUPAC name of (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one (CID 11129707) is (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one.
What is the SMILES notation for (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one?
The canonical SMILES for (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one is C[Si](c1ccccc1)(c1ccccc1)[C@H]1CCC(=O)C1.
What is the InChIKey of (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one?
The InChIKey is NMRVSSZYDLOGFF-SFHVURJKSA-N. The full InChI is InChI=1S/C18H20OSi/c1-20(16-8-4-2-5-9-16,17-10-6-3-7-11-17)18-13-12-15(19)14-18/h2-11,18H,12-14H2,1H3/t18-/m0/s1.
What are the key properties of (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one?
(3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one has a molecular weight of 280.44 g/mol, XLogP of 3.00, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-[methyl(diphenyl)silyl]cyclopentan-1-one is sourced from PubChem (CID 11129707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).