1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one

C15H33NO6Si2 — CID 19362096

IUPAC1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one
SMILESCCO[Si](C)(OCC)O[Si](OCC)(OCC)C(C)N1CCCC1=O
InChIInChI=1S/C15H33NO6Si2/c1-7-18-23(6,19-8-2)22-24(20-9-3,21-10-4)14(5)16-13-11-12-15(16)17/h14H,7-13H2,1-6H3
InChIKeyOWDZZDPNQOOAQL-UHFFFAOYSA-N
MW379.60 g/mol
LogP2.21
Rot. Bonds12

About 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one

1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one (PubChem CID 19362096) has the molecular formula C15H33NO6Si2 and a molecular weight of 379.60 g/mol. Its IUPAC name is 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one
PubChem CID19362096
Molecular FormulaC15H33NO6Si2
Molecular Weight379.60 g/mol
Exact Mass379.18
IUPAC Name1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one
SMILESCCO[Si](C)(OCC)O[Si](OCC)(OCC)C(C)N1CCCC1=O
InChIInChI=1S/C15H33NO6Si2/c1-7-18-23(6,19-8-2)22-24(20-9-3,21-10-4)14(5)16-13-11-12-15(16)17/h14H,7-13H2,1-6H3
InChIKeyOWDZZDPNQOOAQL-UHFFFAOYSA-N
XLogP2.21
TPSA66.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.60
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one?
The IUPAC name of 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one (CID 19362096) is 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one is CCO[Si](C)(OCC)O[Si](OCC)(OCC)C(C)N1CCCC1=O.
What is the InChIKey of 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one?
The InChIKey is OWDZZDPNQOOAQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO6Si2/c1-7-18-23(6,19-8-2)22-24(20-9-3,21-10-4)14(5)16-13-11-12-15(16)17/h14H,7-13H2,1-6H3.
What are the key properties of 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one?
1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one has a molecular weight of 379.60 g/mol, XLogP of 2.21, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[[diethoxy(methyl)silyl]oxy-diethoxysilyl]ethyl]pyrrolidin-2-one is sourced from PubChem (CID 19362096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).