1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one

C9H19NO3Si — CID 19362052

IUPAC1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one
SMILESCO[Si](C)(OC)C(C)N1CCCC1=O
InChIInChI=1S/C9H19NO3Si/c1-8(14(4,12-2)13-3)10-7-5-6-9(10)11/h8H,5-7H2,1-4H3
InChIKeyCXVBHPMYOCTDLZ-UHFFFAOYSA-N
MW217.34 g/mol
LogP0.90
Rot. Bonds4

About 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one

1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one (PubChem CID 19362052) has the molecular formula C9H19NO3Si and a molecular weight of 217.34 g/mol. Its IUPAC name is 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one
PubChem CID19362052
Molecular FormulaC9H19NO3Si
Molecular Weight217.34 g/mol
Exact Mass217.11
IUPAC Name1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one
SMILESCO[Si](C)(OC)C(C)N1CCCC1=O
InChIInChI=1S/C9H19NO3Si/c1-8(14(4,12-2)13-3)10-7-5-6-9(10)11/h8H,5-7H2,1-4H3
InChIKeyCXVBHPMYOCTDLZ-UHFFFAOYSA-N
XLogP0.90
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.34
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one (CID 19362052) is 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one is CO[Si](C)(OC)C(C)N1CCCC1=O.
What is the InChIKey of 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one?
The InChIKey is CXVBHPMYOCTDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO3Si/c1-8(14(4,12-2)13-3)10-7-5-6-9(10)11/h8H,5-7H2,1-4H3.
What are the key properties of 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one?
1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one has a molecular weight of 217.34 g/mol, XLogP of 0.90, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[dimethoxy(methyl)silyl]ethyl]pyrrolidin-2-one is sourced from PubChem (CID 19362052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).