5-methoxy-1-trimethylsilylindole-2,3-dione

C12H15NO3Si — CID 553605

IUPAC5-methoxy-1-trimethylsilylindole-2,3-dione
SMILESCOc1ccc2c(c1)C(=O)C(=O)N2[Si](C)(C)C
InChIInChI=1S/C12H15NO3Si/c1-16-8-5-6-10-9(7-8)11(14)12(15)13(10)17(2,3)4/h5-7H,1-4H3
InChIKeyNCJRUHBKVYYRLM-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.06
Rot. Bonds2

About 5-methoxy-1-trimethylsilylindole-2,3-dione

5-methoxy-1-trimethylsilylindole-2,3-dione (PubChem CID 553605) has the molecular formula C12H15NO3Si and a molecular weight of 249.34 g/mol. Its IUPAC name is 5-methoxy-1-trimethylsilylindole-2,3-dione.

Molecular Properties

Compound Name5-methoxy-1-trimethylsilylindole-2,3-dione
PubChem CID553605
Molecular FormulaC12H15NO3Si
Molecular Weight249.34 g/mol
Exact Mass249.08
IUPAC Name5-methoxy-1-trimethylsilylindole-2,3-dione
SMILESCOc1ccc2c(c1)C(=O)C(=O)N2[Si](C)(C)C
InChIInChI=1S/C12H15NO3Si/c1-16-8-5-6-10-9(7-8)11(14)12(15)13(10)17(2,3)4/h5-7H,1-4H3
InChIKeyNCJRUHBKVYYRLM-UHFFFAOYSA-N
XLogP2.06
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[tert-butyl(dimethyl)silyl]-5-methoxyindole-2,3-dione
CID 616370
5-methoxy-1-(methoxymethyl)indole-2,3-dione
CID 129354242
trifluoro-[(5-methoxy-2,3-dioxoindol-1-yl)methyl]boranuide
CID 63702848
1-(2-ethylsulfonylethyl)-5-methoxyindole-2,3-dione
CID 61355618
1-but-2-ynyl-5-methoxyindole-2,3-dione
CID 55057460
1-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methoxyindole-2,3-dione
CID 79765636
5-methoxy-1-(thiophen-2-ylmethyl)indole-2,3-dione
CID 61356112
1-heptyl-5-methoxyindole-2,3-dione
CID 61354808
1-(3,3-dimethyl-2-oxobutyl)-5-methoxyindole-2,3-dione
CID 62023855
5-methoxy-1-(3-methylsulfonylpropyl)indole-2,3-dione
CID 63191796
5-methoxy-1-(2-phenylethyl)indole-2,3-dione
CID 61355458
1-[(5-bromo-3-pyridinyl)methyl]-5-methoxyindole-2,3-dione
CID 104798464

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-trimethylsilylindole-2,3-dione?
The IUPAC name of 5-methoxy-1-trimethylsilylindole-2,3-dione (CID 553605) is 5-methoxy-1-trimethylsilylindole-2,3-dione.
What is the SMILES notation for 5-methoxy-1-trimethylsilylindole-2,3-dione?
The canonical SMILES for 5-methoxy-1-trimethylsilylindole-2,3-dione is COc1ccc2c(c1)C(=O)C(=O)N2[Si](C)(C)C.
What is the InChIKey of 5-methoxy-1-trimethylsilylindole-2,3-dione?
The InChIKey is NCJRUHBKVYYRLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3Si/c1-16-8-5-6-10-9(7-8)11(14)12(15)13(10)17(2,3)4/h5-7H,1-4H3.
What are the key properties of 5-methoxy-1-trimethylsilylindole-2,3-dione?
5-methoxy-1-trimethylsilylindole-2,3-dione has a molecular weight of 249.34 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-trimethylsilylindole-2,3-dione is sourced from PubChem (CID 553605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).