2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one

C16H32O2Si — CID 154181784

IUPAC2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one
SMILESCCCC(CC)C(=O)[Si](C)(C)C(=O)C(CC)CCC
InChIInChI=1S/C16H32O2Si/c1-7-11-13(9-3)15(17)19(5,6)16(18)14(10-4)12-8-2/h13-14H,7-12H2,1-6H3
InChIKeyAUIOTGHXKHPJJJ-UHFFFAOYSA-N
MW284.52 g/mol
LogP4.56
Rot. Bonds10

About 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one

2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one (PubChem CID 154181784) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one.

Molecular Properties

Compound Name2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one
PubChem CID154181784
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one
SMILESCCCC(CC)C(=O)[Si](C)(C)C(=O)C(CC)CCC
InChIInChI=1S/C16H32O2Si/c1-7-11-13(9-3)15(17)19(5,6)16(18)14(10-4)12-8-2/h13-14H,7-12H2,1-6H3
InChIKeyAUIOTGHXKHPJJJ-UHFFFAOYSA-N
XLogP4.56
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one?
The IUPAC name of 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one (CID 154181784) is 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one.
What is the SMILES notation for 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one?
The canonical SMILES for 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one is CCCC(CC)C(=O)[Si](C)(C)C(=O)C(CC)CCC.
What is the InChIKey of 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one?
The InChIKey is AUIOTGHXKHPJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-7-11-13(9-3)15(17)19(5,6)16(18)14(10-4)12-8-2/h13-14H,7-12H2,1-6H3.
What are the key properties of 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one?
2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one has a molecular weight of 284.52 g/mol, XLogP of 4.56, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-[2-ethylpentanoyl(dimethyl)silyl]pentan-1-one is sourced from PubChem (CID 154181784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).