1-triethylstannylpyrrole-2,5-dione

C10H17NO2Sn — CID 12550575

IUPAC1-triethylstannylpyrrole-2,5-dione
SMILESCC[Sn](CC)(CC)N1C(=O)C=CC1=O
InChIInChI=1S/C4H3NO2.3C2H5.Sn/c6-3-1-2-4(7)5-3;3*1-2;/h1-2H,(H,5,6,7);3*1H2,2H3;/q;;;;+1/p-1
InChIKeyVTMRVFBBLOYPKG-UHFFFAOYSA-M
MW301.96 g/mol
LogP1.92
Rot. Bonds4

About 1-triethylstannylpyrrole-2,5-dione

1-triethylstannylpyrrole-2,5-dione (PubChem CID 12550575) has the molecular formula C10H17NO2Sn and a molecular weight of 301.96 g/mol. Its IUPAC name is 1-triethylstannylpyrrole-2,5-dione.

Molecular Properties

Compound Name1-triethylstannylpyrrole-2,5-dione
PubChem CID12550575
Molecular FormulaC10H17NO2Sn
Molecular Weight301.96 g/mol
Exact Mass303.03
IUPAC Name1-triethylstannylpyrrole-2,5-dione
SMILESCC[Sn](CC)(CC)N1C(=O)C=CC1=O
InChIInChI=1S/C4H3NO2.3C2H5.Sn/c6-3-1-2-4(7)5-3;3*1-2;/h1-2H,(H,5,6,7);3*1H2,2H3;/q;;;;+1/p-1
InChIKeyVTMRVFBBLOYPKG-UHFFFAOYSA-M
XLogP1.92
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.96
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-tert-Butylmaleimide
CID 643190
1-Acetyl-1H-pyrrole-2,5-dione
CID 14041118
N-tributylgermylmaleimide
CID 16702640
1-Tributylstannylpyrrole-2,5-dione
CID 12695969
Carbanide;pyrrol-1-ide-2,5-dione;yttrium
CID 58185087
Ethanone;pyrrol-1-ide-2,5-dione;yttrium
CID 59710638
1-Pent-1-ynylpyrrole-2,5-dione
CID 66671233
Butane;pyrrole-2,5-dione
CID 70488824
Ethane;pyrrole-2,5-dione
CID 90755779
Ethane;1-methylpyrrole-2,5-dione
CID 91118588
Ethane;pyrrole-2,5-dione
CID 91507081
1-[(E)-but-2-enoyl]pyrrole-2,5-dione
CID 137478425

Frequently Asked Questions

What is the IUPAC name of 1-triethylstannylpyrrole-2,5-dione?
The IUPAC name of 1-triethylstannylpyrrole-2,5-dione (CID 12550575) is 1-triethylstannylpyrrole-2,5-dione.
What is the SMILES notation for 1-triethylstannylpyrrole-2,5-dione?
The canonical SMILES for 1-triethylstannylpyrrole-2,5-dione is CC[Sn](CC)(CC)N1C(=O)C=CC1=O.
What is the InChIKey of 1-triethylstannylpyrrole-2,5-dione?
The InChIKey is VTMRVFBBLOYPKG-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H3NO2.3C2H5.Sn/c6-3-1-2-4(7)5-3;3*1-2;/h1-2H,(H,5,6,7);3*1H2,2H3;/q;;;;+1/p-1.
What are the key properties of 1-triethylstannylpyrrole-2,5-dione?
1-triethylstannylpyrrole-2,5-dione has a molecular weight of 301.96 g/mol, XLogP of 1.92, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-triethylstannylpyrrole-2,5-dione is sourced from PubChem (CID 12550575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).