2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane

C23H28ClN3OSi — CID 174145548

IUPAC2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane
SMILESCC(OCC[Si](C)(C)C)c1cc2[nH]ccc2cc1-c1cc2cc(Cl)ncc2n1C
InChIInChI=1S/C23H28ClN3OSi/c1-15(28-8-9-29(3,4)5)18-13-20-16(6-7-25-20)10-19(18)21-11-17-12-23(24)26-14-22(17)27(21)2/h6-7,10-15,25H,8-9H2,1-5H3
InChIKeyRYINLYFIRJTHIY-UHFFFAOYSA-N
MW426.04 g/mol
LogP6.79
Rot. Bonds6

About 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane

2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane (PubChem CID 174145548) has the molecular formula C23H28ClN3OSi and a molecular weight of 426.04 g/mol. Its IUPAC name is 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane.

Molecular Properties

Compound Name2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane
PubChem CID174145548
Molecular FormulaC23H28ClN3OSi
Molecular Weight426.04 g/mol
Exact Mass425.17
IUPAC Name2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane
SMILESCC(OCC[Si](C)(C)C)c1cc2[nH]ccc2cc1-c1cc2cc(Cl)ncc2n1C
InChIInChI=1S/C23H28ClN3OSi/c1-15(28-8-9-29(3,4)5)18-13-20-16(6-7-25-20)10-19(18)21-11-17-12-23(24)26-14-22(17)27(21)2/h6-7,10-15,25H,8-9H2,1-5H3
InChIKeyRYINLYFIRJTHIY-UHFFFAOYSA-N
XLogP6.79
TPSA42.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.04
LogP ≤ 56.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane?
The IUPAC name of 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane (CID 174145548) is 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane is CC(OCC[Si](C)(C)C)c1cc2[nH]ccc2cc1-c1cc2cc(Cl)ncc2n1C.
What is the InChIKey of 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane?
The InChIKey is RYINLYFIRJTHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28ClN3OSi/c1-15(28-8-9-29(3,4)5)18-13-20-16(6-7-25-20)10-19(18)21-11-17-12-23(24)26-14-22(17)27(21)2/h6-7,10-15,25H,8-9H2,1-5H3.
What are the key properties of 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane?
2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane has a molecular weight of 426.04 g/mol, XLogP of 6.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[5-(5-chloro-1-methylpyrrolo[2,3-c]pyridin-2-yl)-1H-indol-6-yl]ethoxy]ethyl-trimethylsilane is sourced from PubChem (CID 174145548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).