triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane

C18H28FNSi — CID 163799390

IUPACtriethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane
SMILESCC[Si](CC)(CC)c1[nH]c2cccc(F)c2c1CC(C)C
InChIInChI=1S/C18H28FNSi/c1-6-21(7-2,8-3)18-14(12-13(4)5)17-15(19)10-9-11-16(17)20-18/h9-11,13,20H,6-8,12H2,1-5H3
InChIKeyFIXOBJOCHSEOND-UHFFFAOYSA-N
MW305.51 g/mol
LogP5.22
Rot. Bonds6

About triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane

triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane (PubChem CID 163799390) has the molecular formula C18H28FNSi and a molecular weight of 305.51 g/mol. Its IUPAC name is triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane.

Molecular Properties

Compound Nametriethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane
PubChem CID163799390
Molecular FormulaC18H28FNSi
Molecular Weight305.51 g/mol
Exact Mass305.20
IUPAC Nametriethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane
SMILESCC[Si](CC)(CC)c1[nH]c2cccc(F)c2c1CC(C)C
InChIInChI=1S/C18H28FNSi/c1-6-21(7-2,8-3)18-14(12-13(4)5)17-15(19)10-9-11-16(17)20-18/h9-11,13,20H,6-8,12H2,1-5H3
InChIKeyFIXOBJOCHSEOND-UHFFFAOYSA-N
XLogP5.22
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.51
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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 triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane?
The IUPAC name of triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane (CID 163799390) is triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane.
What is the SMILES notation for triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane?
The canonical SMILES for triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane is CC[Si](CC)(CC)c1[nH]c2cccc(F)c2c1CC(C)C.
What is the InChIKey of triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane?
The InChIKey is FIXOBJOCHSEOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28FNSi/c1-6-21(7-2,8-3)18-14(12-13(4)5)17-15(19)10-9-11-16(17)20-18/h9-11,13,20H,6-8,12H2,1-5H3.
What are the key properties of triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane?
triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane has a molecular weight of 305.51 g/mol, XLogP of 5.22, 6 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[4-fluoro-3-(2-methylpropyl)-1H-indol-2-yl]silane is sourced from PubChem (CID 163799390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).