1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione

C10H17NO5Si — CID 18442227

IUPAC1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione
SMILESCCC(N1C(=O)C=CC1=O)[Si](OC)(OC)OC
InChIInChI=1S/C10H17NO5Si/c1-5-10(17(14-2,15-3)16-4)11-8(12)6-7-9(11)13/h6-7,10H,5H2,1-4H3
InChIKeyAIEYFOQGYPAKEL-UHFFFAOYSA-N
MW259.33 g/mol
LogP0.11
Rot. Bonds6

About 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione

1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione (PubChem CID 18442227) has the molecular formula C10H17NO5Si and a molecular weight of 259.33 g/mol. Its IUPAC name is 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione
PubChem CID18442227
Molecular FormulaC10H17NO5Si
Molecular Weight259.33 g/mol
Exact Mass259.09
IUPAC Name1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione
SMILESCCC(N1C(=O)C=CC1=O)[Si](OC)(OC)OC
InChIInChI=1S/C10H17NO5Si/c1-5-10(17(14-2,15-3)16-4)11-8(12)6-7-9(11)13/h6-7,10H,5H2,1-4H3
InChIKeyAIEYFOQGYPAKEL-UHFFFAOYSA-N
XLogP0.11
TPSA65.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 50.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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-(1-trimethoxysilylpropyl)pyrrole-2,5-dione?
The IUPAC name of 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione (CID 18442227) is 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione?
The canonical SMILES for 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione is CCC(N1C(=O)C=CC1=O)[Si](OC)(OC)OC.
What is the InChIKey of 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione?
The InChIKey is AIEYFOQGYPAKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO5Si/c1-5-10(17(14-2,15-3)16-4)11-8(12)6-7-9(11)13/h6-7,10H,5H2,1-4H3.
What are the key properties of 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione?
1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione has a molecular weight of 259.33 g/mol, XLogP of 0.11, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-trimethoxysilylpropyl)pyrrole-2,5-dione is sourced from PubChem (CID 18442227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).