trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane

C24H27N3O2Si — CID 146169587

About trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane

trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane (PubChem CID 146169587) has the molecular formula C24H27N3O2Si and a molecular weight of 417.59 g/mol. Its IUPAC name is trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane.

Molecular Properties

• Compound Name: trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane
• PubChem CID: 146169587
• Molecular Formula: C24H27N3O2Si
• Molecular Weight: 417.59 g/mol
• Exact Mass: 417.19
• IUPAC Name: trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane
• SMILES: C[Si](C)(C)CCOCn1cc(-c2ccccc2)c2c(Oc3cccnc3)ccnc21
• InChI: InChI=1S/C24H27N3O2Si/c1-30(2,3)15-14-28-18-27-17-21(19-8-5-4-6-9-19)23-22(11-13-26-24(23)27)29-20-10-7-12-25-16-20/h4-13,16-17H,14-15,18H2,1-3H3
• InChIKey: OIWWYXGNYZUIQT-UHFFFAOYSA-N
• XLogP: 6.20
• TPSA: 49.17 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	417.59
LogP ≤ 5	6.20
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane?

The IUPAC name of trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane (CID 146169587) is trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane.

What is the SMILES notation for trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane?

The canonical SMILES for trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane is C[Si](C)(C)CCOCn1cc(-c2ccccc2)c2c(Oc3cccnc3)ccnc21.

What is the InChIKey of trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane?

The InChIKey is OIWWYXGNYZUIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2Si/c1-30(2,3)15-14-28-18-27-17-21(19-8-5-4-6-9-19)23-22(11-13-26-24(23)27)29-20-10-7-12-25-16-20/h4-13,16-17H,14-15,18H2,1-3H3.

What are the key properties of trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane?

trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane has a molecular weight of 417.59 g/mol, XLogP of 6.20, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for trimethyl-[2-[(3-phenyl-4-pyridin-3-yloxypyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl]silane is sourced from PubChem (CID 146169587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).