2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane

C16H23Cl2NO2Si — CID 170550459

IUPAC2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane
SMILESCCOc1cc(Cl)c(Cl)c2c1ccn2COCC[Si](C)(C)C
InChIInChI=1S/C16H23Cl2NO2Si/c1-5-21-14-10-13(17)15(18)16-12(14)6-7-19(16)11-20-8-9-22(2,3)4/h6-7,10H,5,8-9,11H2,1-4H3
InChIKeyIGOGZRCNEIDJGZ-UHFFFAOYSA-N
MW360.36 g/mol
LogP5.66
Rot. Bonds7

About 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane

2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane (PubChem CID 170550459) has the molecular formula C16H23Cl2NO2Si and a molecular weight of 360.36 g/mol. Its IUPAC name is 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane
PubChem CID170550459
Molecular FormulaC16H23Cl2NO2Si
Molecular Weight360.36 g/mol
Exact Mass359.09
IUPAC Name2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane
SMILESCCOc1cc(Cl)c(Cl)c2c1ccn2COCC[Si](C)(C)C
InChIInChI=1S/C16H23Cl2NO2Si/c1-5-21-14-10-13(17)15(18)16-12(14)6-7-19(16)11-20-8-9-22(2,3)4/h6-7,10H,5,8-9,11H2,1-4H3
InChIKeyIGOGZRCNEIDJGZ-UHFFFAOYSA-N
XLogP5.66
TPSA23.39 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.36
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

7-chloro-1-[3-fluoro-4-(methyloxy)phenyl]-4-(methyloxy)-1H-indole
CID 59627926
7-Chloro-1-(2-methoxy-ethyl)-4-trifluoromethoxy-1H-indole
CID 69922346
6,7-dichloro-4-(2,2-difluoroethoxy)-1H-indole
CID 170426567
6,7-dichloro-4-(3-fluorocyclobutyl)oxy-3-iodo-1H-indole
CID 170426574
6,7-Dichloro-4-(2-fluoroethoxy)-1-(4-methylphenyl)sulfonylindole
CID 170426664
6,7-dichloro-4-(2-fluoroethoxy)-3-iodo-1H-indole
CID 170427364
6,7-dichloro-4-(3-fluorocyclobutyl)oxy-1H-indole
CID 170427366
6,7-Dichloro-4-(2,2-difluoroethoxy)-1-(4-methylphenyl)sulfonylindole
CID 170427426
6,7-dichloro-4-(2,2-difluoroethoxy)-3-iodo-1H-indole
CID 170427716
6,7-dichloro-4-(2-fluoroethoxy)-1H-indole
CID 170427749
2-[6-Chloro-7-fluoro-3-iodo-1-(2-trimethylsilylethoxymethyl)indol-4-yl]oxyacetonitrile
CID 170550487
6,7-Dichloro-4-(3-fluorocyclobutyl)oxy-1-(4-methylphenyl)sulfanylindole
CID 170610027

Frequently Asked Questions

What is the IUPAC name of 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane (CID 170550459) is 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane is CCOc1cc(Cl)c(Cl)c2c1ccn2COCC[Si](C)(C)C.
What is the InChIKey of 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane?
The InChIKey is IGOGZRCNEIDJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23Cl2NO2Si/c1-5-21-14-10-13(17)15(18)16-12(14)6-7-19(16)11-20-8-9-22(2,3)4/h6-7,10H,5,8-9,11H2,1-4H3.
What are the key properties of 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane?
2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane has a molecular weight of 360.36 g/mol, XLogP of 5.66, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6,7-dichloro-4-ethoxyindol-1-yl)methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 170550459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).