1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione

C11H19NO3Si — CID 22593490

IUPAC1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione
SMILESCCO[Si](C)(C)CCCN1C(=O)C=CC1=O
InChIInChI=1S/C11H19NO3Si/c1-4-15-16(2,3)9-5-8-12-10(13)6-7-11(12)14/h6-7H,4-5,8-9H2,1-3H3
InChIKeyVCJSOIJUTVYKID-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.54
Rot. Bonds6

About 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione

1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione (PubChem CID 22593490) has the molecular formula C11H19NO3Si and a molecular weight of 241.36 g/mol. Its IUPAC name is 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione.

Molecular Properties

Compound Name1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione
PubChem CID22593490
Molecular FormulaC11H19NO3Si
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC Name1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione
SMILESCCO[Si](C)(C)CCCN1C(=O)C=CC1=O
InChIInChI=1S/C11H19NO3Si/c1-4-15-16(2,3)9-5-8-12-10(13)6-7-11(12)14/h6-7H,4-5,8-9H2,1-3H3
InChIKeyVCJSOIJUTVYKID-UHFFFAOYSA-N
XLogP1.54
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione?
The IUPAC name of 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione (CID 22593490) is 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione.
What is the SMILES notation for 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione?
The canonical SMILES for 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione is CCO[Si](C)(C)CCCN1C(=O)C=CC1=O.
What is the InChIKey of 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione?
The InChIKey is VCJSOIJUTVYKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3Si/c1-4-15-16(2,3)9-5-8-12-10(13)6-7-11(12)14/h6-7H,4-5,8-9H2,1-3H3.
What are the key properties of 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione?
1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione has a molecular weight of 241.36 g/mol, XLogP of 1.54, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[ethoxy(dimethyl)silyl]propyl]pyrrole-2,5-dione is sourced from PubChem (CID 22593490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).