2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione

C15H19NO2Si — CID 90361347

IUPAC2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione
SMILESCC1([Si](C)(C)C)CC1N1C(=O)c2ccccc2C1=O
InChIInChI=1S/C15H19NO2Si/c1-15(19(2,3)4)9-12(15)16-13(17)10-7-5-6-8-11(10)14(16)18/h5-8,12H,9H2,1-4H3
InChIKeyNIPNFIRZKVKUKR-UHFFFAOYSA-N
MW273.41 g/mol
LogP3.15
Rot. Bonds2

About 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione

2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione (PubChem CID 90361347) has the molecular formula C15H19NO2Si and a molecular weight of 273.41 g/mol. Its IUPAC name is 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione.

Molecular Properties

Compound Name2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione
PubChem CID90361347
Molecular FormulaC15H19NO2Si
Molecular Weight273.41 g/mol
Exact Mass273.12
IUPAC Name2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione
SMILESCC1([Si](C)(C)C)CC1N1C(=O)c2ccccc2C1=O
InChIInChI=1S/C15H19NO2Si/c1-15(19(2,3)4)9-12(15)16-13(17)10-7-5-6-8-11(10)14(16)18/h5-8,12H,9H2,1-4H3
InChIKeyNIPNFIRZKVKUKR-UHFFFAOYSA-N
XLogP3.15
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.41
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-Methylphthalimide
CID 11074
Isopropylphthalimide
CID 67535
N-(hydroxymethyl)phthalimide
CID 8354
N-Butylphthalimide
CID 73812
Chloromethylphthalimide
CID 87154
N-Ethylphthalimide
CID 21120
N-(2-Methylallyl)-phthalimide
CID 231838
alpha-Phthalimidopropiophenone
CID 519663
N-Cyclohexylphthalimide
CID 225739
Phthalimidoacetone
CID 235046
2-(Sulfanylmethyl)isoindole-1,3-dione
CID 10987117
PIMOM (N-Methoxymethyl phthalimide
CID 12246933

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione?
The IUPAC name of 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione (CID 90361347) is 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione.
What is the SMILES notation for 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione?
The canonical SMILES for 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione is CC1([Si](C)(C)C)CC1N1C(=O)c2ccccc2C1=O.
What is the InChIKey of 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione?
The InChIKey is NIPNFIRZKVKUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2Si/c1-15(19(2,3)4)9-12(15)16-13(17)10-7-5-6-8-11(10)14(16)18/h5-8,12H,9H2,1-4H3.
What are the key properties of 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione?
2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione has a molecular weight of 273.41 g/mol, XLogP of 3.15, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-2-trimethylsilylcyclopropyl)isoindole-1,3-dione is sourced from PubChem (CID 90361347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).