3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one

C16H32OSi — CID 11230979

IUPAC3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one
SMILESCCCCC(C1CCC(=O)C1)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-7-8-9-15(13-10-11-14(17)12-13)18(5,6)16(2,3)4/h13,15H,7-12H2,1-6H3
InChIKeyMHBHUZVFTHCKOD-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.42
Rot. Bonds5

About 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one

3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one (PubChem CID 11230979) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one.

Molecular Properties

Compound Name3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one
PubChem CID11230979
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Name3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one
SMILESCCCCC(C1CCC(=O)C1)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-7-8-9-15(13-10-11-14(17)12-13)18(5,6)16(2,3)4/h13,15H,7-12H2,1-6H3
InChIKeyMHBHUZVFTHCKOD-UHFFFAOYSA-N
XLogP5.42
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.42
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

1-Cyclopentylhexacosan-4-one
CID 14132245
2-Undecylcyclopentanone
CID 10857543
1-Cyclopentyl-1-hexadecanone
CID 549696
2-(Trimethylsilylmethyl)cyclopentan-1-one
CID 10964965
2-Dodecylcyclopentanone
CID 55188422
2-Pentadecylcyclopentanone
CID 54368552
2-Octadecylcyclopentanone
CID 91698417
(2R)-2-undecylcyclopentan-1-one
CID 10911612
2-(Trimethylsilylmethyl)cycloheptan-1-one
CID 14085476
Cetylcyclopentanone
CID 129808500
cyclopentyl-[(1R,3R)-3-[fluoro(dimethyl)silyl]cyclopentyl]methanone
CID 10562164
1-[(1R,3R)-3-[fluoro-di(propan-2-yl)silyl]cyclopentyl]ethanone
CID 10586423

Frequently Asked Questions

What is the IUPAC name of 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one?
The IUPAC name of 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one (CID 11230979) is 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one.
What is the SMILES notation for 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one?
The canonical SMILES for 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one is CCCCC(C1CCC(=O)C1)[Si](C)(C)C(C)(C)C.
What is the InChIKey of 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one?
The InChIKey is MHBHUZVFTHCKOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-7-8-9-15(13-10-11-14(17)12-13)18(5,6)16(2,3)4/h13,15H,7-12H2,1-6H3.
What are the key properties of 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one?
3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one has a molecular weight of 268.52 g/mol, XLogP of 5.42, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[tert-butyl(dimethyl)silyl]pentyl]cyclopentan-1-one is sourced from PubChem (CID 11230979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).