trimethyl-(5-nitroindol-1-yl)silane

C11H14N2O2Si — CID 553560

IUPACtrimethyl-(5-nitroindol-1-yl)silane
SMILESC[Si](C)(C)n1ccc2cc([N+](=O)[O-])ccc21
InChIInChI=1S/C11H14N2O2Si/c1-16(2,3)12-7-6-9-8-10(13(14)15)4-5-11(9)12/h4-8H,1-3H3
InChIKeyABQOTJVKINFZJG-UHFFFAOYSA-N
MW234.33 g/mol
LogP3.23
Rot. Bonds2

About trimethyl-(5-nitroindol-1-yl)silane

trimethyl-(5-nitroindol-1-yl)silane (PubChem CID 553560) has the molecular formula C11H14N2O2Si and a molecular weight of 234.33 g/mol. Its IUPAC name is trimethyl-(5-nitroindol-1-yl)silane.

Molecular Properties

Compound Nametrimethyl-(5-nitroindol-1-yl)silane
PubChem CID553560
Molecular FormulaC11H14N2O2Si
Molecular Weight234.33 g/mol
Exact Mass234.08
IUPAC Nametrimethyl-(5-nitroindol-1-yl)silane
SMILESC[Si](C)(C)n1ccc2cc([N+](=O)[O-])ccc21
InChIInChI=1S/C11H14N2O2Si/c1-16(2,3)12-7-6-9-8-10(13(14)15)4-5-11(9)12/h4-8H,1-3H3
InChIKeyABQOTJVKINFZJG-UHFFFAOYSA-N
XLogP3.23
TPSA48.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.33
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethane;5-nitro-1-propan-2-ylindole
CID 143287721
5-nitroindol-1-amine
CID 10583430
1-(5-nitroindol-1-yl)ethanol
CID 141070113
1-(2-methylsulfinylpyrimidin-4-yl)-5-nitroindole
CID 135203748
1-(5-nitroindol-1-yl)propan-2-ol
CID 116619106
1-(2-methylprop-2-enyl)-5-nitroindole
CID 116619158
2-(5-nitroindol-1-yl)propanoic acid
CID 60756249
N-methyl-2-(5-nitroindol-1-yl)acetamide
CID 47460620
1-(5-nitroindol-1-yl)butan-2-one
CID 62041234
1-(4-chlorophenyl)-5-nitroindole
CID 102404578
methyl-[4-(5-nitroindol-1-yl)pyrimidin-2-yl]-sulfanylidene-λ4-sulfane
CID 141461598
(2R,3S,4R)-2-(hydroxymethyl)-5-(5-nitroindol-1-yl)oxolane-3,4-diol
CID 11197152

Frequently Asked Questions

What is the IUPAC name of trimethyl-(5-nitroindol-1-yl)silane?
The IUPAC name of trimethyl-(5-nitroindol-1-yl)silane (CID 553560) is trimethyl-(5-nitroindol-1-yl)silane.
What is the SMILES notation for trimethyl-(5-nitroindol-1-yl)silane?
The canonical SMILES for trimethyl-(5-nitroindol-1-yl)silane is C[Si](C)(C)n1ccc2cc([N+](=O)[O-])ccc21.
What is the InChIKey of trimethyl-(5-nitroindol-1-yl)silane?
The InChIKey is ABQOTJVKINFZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2Si/c1-16(2,3)12-7-6-9-8-10(13(14)15)4-5-11(9)12/h4-8H,1-3H3.
What are the key properties of trimethyl-(5-nitroindol-1-yl)silane?
trimethyl-(5-nitroindol-1-yl)silane has a molecular weight of 234.33 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(5-nitroindol-1-yl)silane is sourced from PubChem (CID 553560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).