2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane

C14H19BrClNOSi — CID 140807311

IUPAC2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1ccc2c(Br)cc(Cl)cc21
InChIInChI=1S/C14H19BrClNOSi/c1-19(2,3)7-6-18-10-17-5-4-12-13(15)8-11(16)9-14(12)17/h4-5,8-9H,6-7,10H2,1-3H3
InChIKeyGYAWMGYTSJPJAB-UHFFFAOYSA-N
MW360.76 g/mol
LogP5.37
Rot. Bonds5

About 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane

2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane (PubChem CID 140807311) has the molecular formula C14H19BrClNOSi and a molecular weight of 360.76 g/mol. Its IUPAC name is 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane
PubChem CID140807311
Molecular FormulaC14H19BrClNOSi
Molecular Weight360.76 g/mol
Exact Mass359.01
IUPAC Name2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane
SMILESC[Si](C)(C)CCOCn1ccc2c(Br)cc(Cl)cc21
InChIInChI=1S/C14H19BrClNOSi/c1-19(2,3)7-6-18-10-17-5-4-12-13(15)8-11(16)9-14(12)17/h4-5,8-9H,6-7,10H2,1-3H3
InChIKeyGYAWMGYTSJPJAB-UHFFFAOYSA-N
XLogP5.37
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.76
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

2-[(6-chloro-4-nitroindol-1-yl)methoxy]ethyl-trimethylsilane
CID 131736189
2-[(4-bromo-5-methoxypyrrolo[2,3-c]pyridin-1-yl)methoxy]ethyl-trimethylsilane
CID 66599709
2-[[6-chloro-4-(2,4,6-trichlorophenoxy)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl-trimethylsilane
CID 101395266
2-[[4-(4-bromo-3-fluorophenoxy)pyrrolo[3,2-c]pyridin-1-yl]methoxy]ethyl-trimethylsilane
CID 90117077
2-[(2-bromo-3-fluoropyrrol-1-yl)methoxy]ethyl-trimethylsilane
CID 175192974
2-[(2-chloro-4-ethenylpyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethyl-trimethylsilane
CID 87223684
5-bromo-N-propan-2-yl-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-amine
CID 162477897
trimethyl-[2-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indol-1-yl]methoxy]ethyl]silane
CID 169306021
trimethyl-[2-[(4-methylpyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethyl]silane
CID 59420154
(R)-N-[(1R)-1-[4-(difluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-6-yl]ethyl]-2-methylpropane-2-sulfinamide
CID 156681762
4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carbaldehyde
CID 86676739
4,6-dibromo-2-(2-trimethylsilylethoxymethyl)isoquinolin-1-one
CID 140829624

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane (CID 140807311) is 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCn1ccc2c(Br)cc(Cl)cc21.
What is the InChIKey of 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane?
The InChIKey is GYAWMGYTSJPJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrClNOSi/c1-19(2,3)7-6-18-10-17-5-4-12-13(15)8-11(16)9-14(12)17/h4-5,8-9H,6-7,10H2,1-3H3.
What are the key properties of 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane?
2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane has a molecular weight of 360.76 g/mol, XLogP of 5.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromo-6-chloroindol-1-yl)methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 140807311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).