6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde

C10H9FN2O2 — CID 175833363

IUPAC6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde
SMILESCCOc1ccc2c(C=O)c(F)nn2c1
InChIInChI=1S/C10H9FN2O2/c1-2-15-7-3-4-9-8(6-14)10(11)12-13(9)5-7/h3-6H,2H2,1H3
InChIKeyATUHEGBGPKXIHD-UHFFFAOYSA-N
MW208.19 g/mol
LogP1.68
Rot. Bonds3

About 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde

6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde (PubChem CID 175833363) has the molecular formula C10H9FN2O2 and a molecular weight of 208.19 g/mol. Its IUPAC name is 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde
PubChem CID175833363
Molecular FormulaC10H9FN2O2
Molecular Weight208.19 g/mol
Exact Mass208.06
IUPAC Name6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde
SMILESCCOc1ccc2c(C=O)c(F)nn2c1
InChIInChI=1S/C10H9FN2O2/c1-2-15-7-3-4-9-8(6-14)10(11)12-13(9)5-7/h3-6H,2H2,1H3
InChIKeyATUHEGBGPKXIHD-UHFFFAOYSA-N
XLogP1.68
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde?
The IUPAC name of 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde (CID 175833363) is 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde?
The canonical SMILES for 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde is CCOc1ccc2c(C=O)c(F)nn2c1.
What is the InChIKey of 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde?
The InChIKey is ATUHEGBGPKXIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O2/c1-2-15-7-3-4-9-8(6-14)10(11)12-13(9)5-7/h3-6H,2H2,1H3.
What are the key properties of 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde?
6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde has a molecular weight of 208.19 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-fluoropyrazolo[1,5-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 175833363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).