2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid

C14H19NO3Si — CID 68691634

IUPAC2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid
SMILESCC[Si](CC)(CC)c1cc2cc(C(=O)O)cnc2o1
InChIInChI=1S/C14H19NO3Si/c1-4-19(5-2,6-3)12-8-10-7-11(14(16)17)9-15-13(10)18-12/h7-9H,4-6H2,1-3H3,(H,16,17)
InChIKeyZVHIANOAERWJND-UHFFFAOYSA-N
MW277.40 g/mol
LogP3.24
Rot. Bonds5

About 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid

2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid (PubChem CID 68691634) has the molecular formula C14H19NO3Si and a molecular weight of 277.40 g/mol. Its IUPAC name is 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid
PubChem CID68691634
Molecular FormulaC14H19NO3Si
Molecular Weight277.40 g/mol
Exact Mass277.11
IUPAC Name2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid
SMILESCC[Si](CC)(CC)c1cc2cc(C(=O)O)cnc2o1
InChIInChI=1S/C14H19NO3Si/c1-4-19(5-2,6-3)12-8-10-7-11(14(16)17)9-15-13(10)18-12/h7-9H,4-6H2,1-3H3,(H,16,17)
InChIKeyZVHIANOAERWJND-UHFFFAOYSA-N
XLogP3.24
TPSA63.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.40
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid?
The IUPAC name of 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid (CID 68691634) is 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid.
What is the SMILES notation for 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid?
The canonical SMILES for 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid is CC[Si](CC)(CC)c1cc2cc(C(=O)O)cnc2o1.
What is the InChIKey of 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid?
The InChIKey is ZVHIANOAERWJND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3Si/c1-4-19(5-2,6-3)12-8-10-7-11(14(16)17)9-15-13(10)18-12/h7-9H,4-6H2,1-3H3,(H,16,17).
What are the key properties of 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid?
2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid has a molecular weight of 277.40 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-triethylsilylfuro[2,3-b]pyridine-5-carboxylic acid is sourced from PubChem (CID 68691634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).