2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine

C14H23Cl2NOSi — CID 123856251

IUPAC2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine
SMILESCC[Si](CC)(CC)OC(CN)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H23Cl2NOSi/c1-4-19(5-2,6-3)18-13(10-17)14-11(15)8-7-9-12(14)16/h7-9,13H,4-6,10,17H2,1-3H3
InChIKeyNNRCBYPPRXLFTD-UHFFFAOYSA-N
MW320.34 g/mol
LogP5.01
Rot. Bonds7

About 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine

2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine (PubChem CID 123856251) has the molecular formula C14H23Cl2NOSi and a molecular weight of 320.34 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine
PubChem CID123856251
Molecular FormulaC14H23Cl2NOSi
Molecular Weight320.34 g/mol
Exact Mass319.09
IUPAC Name2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine
SMILESCC[Si](CC)(CC)OC(CN)c1c(Cl)cccc1Cl
InChIInChI=1S/C14H23Cl2NOSi/c1-4-19(5-2,6-3)18-13(10-17)14-11(15)8-7-9-12(14)16/h7-9,13H,4-6,10,17H2,1-3H3
InChIKeyNNRCBYPPRXLFTD-UHFFFAOYSA-N
XLogP5.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.34
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine?
The IUPAC name of 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine (CID 123856251) is 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine is CC[Si](CC)(CC)OC(CN)c1c(Cl)cccc1Cl.
What is the InChIKey of 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine?
The InChIKey is NNRCBYPPRXLFTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23Cl2NOSi/c1-4-19(5-2,6-3)18-13(10-17)14-11(15)8-7-9-12(14)16/h7-9,13H,4-6,10,17H2,1-3H3.
What are the key properties of 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine?
2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine has a molecular weight of 320.34 g/mol, XLogP of 5.01, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-2-triethylsilyloxyethanamine is sourced from PubChem (CID 123856251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).