1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one

C8H16FNOSi — CID 174136335

IUPAC1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one
SMILESC[Si](C)(F)CCN1CCCC1=O
InChIInChI=1S/C8H16FNOSi/c1-12(2,9)7-6-10-5-3-4-8(10)11/h3-7H2,1-2H3
InChIKeyUCWSRKODPPRAIY-UHFFFAOYSA-N
MW189.31 g/mol
LogP1.78
Rot. Bonds3

About 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one

1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one (PubChem CID 174136335) has the molecular formula C8H16FNOSi and a molecular weight of 189.31 g/mol. Its IUPAC name is 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one
PubChem CID174136335
Molecular FormulaC8H16FNOSi
Molecular Weight189.31 g/mol
Exact Mass189.10
IUPAC Name1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one
SMILESC[Si](C)(F)CCN1CCCC1=O
InChIInChI=1S/C8H16FNOSi/c1-12(2,9)7-6-10-5-3-4-8(10)11/h3-7H2,1-2H3
InChIKeyUCWSRKODPPRAIY-UHFFFAOYSA-N
XLogP1.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.31
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(Trimethylsilyl)pyrrolidin-2-one
CID 84461
1-Methyl-3-(trimethylsilyl)pyrrolidin-2-one
CID 3055555
2-Pyrrolidinone, 1-(1-(triethoxysilyl)ethyl)-
CID 3071421
1-[(E)-2-trimethylsilylethenyl]pyrrolidin-2-one
CID 12174701
N-(trifluorosilylmethyl)-2-pyrrolidone
CID 12092366
N-[2-(trifluorosilylethyl)]-2-pyrrolidone
CID 129772006
N-[2-(trifluorosilyl)ethyl]-2-pyrrolidone
CID 129772027
1-(Dimethylfluorosilylmethyl)-2-pyrrolidone
CID 129879387
1-[2-[Difluoro(methyl)silyl]ethyl]pyrrolidin-2-one
CID 174136159
N,N-diethyl-3-[fluoro(dimethyl)silyl]propanamide
CID 174136355
1-(tert-Butyldimethylsilyl)pyrrolidin-2-one
CID 15197041
1-(4-Trimethylsilylbut-3-ynyl)pyrrolidin-2-one
CID 12842578

Frequently Asked Questions

What is the IUPAC name of 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one (CID 174136335) is 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one is C[Si](C)(F)CCN1CCCC1=O.
What is the InChIKey of 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one?
The InChIKey is UCWSRKODPPRAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNOSi/c1-12(2,9)7-6-10-5-3-4-8(10)11/h3-7H2,1-2H3.
What are the key properties of 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one?
1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one has a molecular weight of 189.31 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[fluoro(dimethyl)silyl]ethyl]pyrrolidin-2-one is sourced from PubChem (CID 174136335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).