(1-benzylindol-2-yl)-triethylsilane

C21H27NSi — CID 90095967

IUPAC(1-benzylindol-2-yl)-triethylsilane
SMILESCC[Si](CC)(CC)c1cc2ccccc2n1Cc1ccccc1
InChIInChI=1S/C21H27NSi/c1-4-23(5-2,6-3)21-16-19-14-10-11-15-20(19)22(21)17-18-12-8-7-9-13-18/h7-16H,4-6,17H2,1-3H3
InChIKeyMGUCZDRSLIVRNT-UHFFFAOYSA-N
MW321.54 g/mol
LogP5.41
Rot. Bonds6

About (1-benzylindol-2-yl)-triethylsilane

(1-benzylindol-2-yl)-triethylsilane (PubChem CID 90095967) has the molecular formula C21H27NSi and a molecular weight of 321.54 g/mol. Its IUPAC name is (1-benzylindol-2-yl)-triethylsilane.

Molecular Properties

Compound Name(1-benzylindol-2-yl)-triethylsilane
PubChem CID90095967
Molecular FormulaC21H27NSi
Molecular Weight321.54 g/mol
Exact Mass321.19
IUPAC Name(1-benzylindol-2-yl)-triethylsilane
SMILESCC[Si](CC)(CC)c1cc2ccccc2n1Cc1ccccc1
InChIInChI=1S/C21H27NSi/c1-4-23(5-2,6-3)21-16-19-14-10-11-15-20(19)22(21)17-18-12-8-7-9-13-18/h7-16H,4-6,17H2,1-3H3
InChIKeyMGUCZDRSLIVRNT-UHFFFAOYSA-N
XLogP5.41
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.54
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-benzylindol-2-yl)-triethylsilane?
The IUPAC name of (1-benzylindol-2-yl)-triethylsilane (CID 90095967) is (1-benzylindol-2-yl)-triethylsilane.
What is the SMILES notation for (1-benzylindol-2-yl)-triethylsilane?
The canonical SMILES for (1-benzylindol-2-yl)-triethylsilane is CC[Si](CC)(CC)c1cc2ccccc2n1Cc1ccccc1.
What is the InChIKey of (1-benzylindol-2-yl)-triethylsilane?
The InChIKey is MGUCZDRSLIVRNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NSi/c1-4-23(5-2,6-3)21-16-19-14-10-11-15-20(19)22(21)17-18-12-8-7-9-13-18/h7-16H,4-6,17H2,1-3H3.
What are the key properties of (1-benzylindol-2-yl)-triethylsilane?
(1-benzylindol-2-yl)-triethylsilane has a molecular weight of 321.54 g/mol, XLogP of 5.41, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzylindol-2-yl)-triethylsilane is sourced from PubChem (CID 90095967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).