2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde

C9H8N2O2 — CID 89042032

IUPAC2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde
SMILESO=Cc1cccc2cc(CO)nn12
InChIInChI=1S/C9H8N2O2/c12-5-7-4-8-2-1-3-9(6-13)11(8)10-7/h1-4,6,12H,5H2
InChIKeyZWUWFZREQSBWBG-UHFFFAOYSA-N
MW176.17 g/mol
LogP0.64
Rot. Bonds2

About 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde

2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde (PubChem CID 89042032) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde.

Molecular Properties

Compound Name2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde
PubChem CID89042032
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde
SMILESO=Cc1cccc2cc(CO)nn12
InChIInChI=1S/C9H8N2O2/c12-5-7-4-8-2-1-3-9(6-13)11(8)10-7/h1-4,6,12H,5H2
InChIKeyZWUWFZREQSBWBG-UHFFFAOYSA-N
XLogP0.64
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 50.64
H-Bond Donors ≤ 51
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 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde?
The IUPAC name of 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde (CID 89042032) is 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde.
What is the SMILES notation for 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde?
The canonical SMILES for 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde is O=Cc1cccc2cc(CO)nn12.
What is the InChIKey of 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde?
The InChIKey is ZWUWFZREQSBWBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c12-5-7-4-8-2-1-3-9(6-13)11(8)10-7/h1-4,6,12H,5H2.
What are the key properties of 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde?
2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde has a molecular weight of 176.17 g/mol, XLogP of 0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)pyrazolo[1,5-a]pyridine-7-carbaldehyde is sourced from PubChem (CID 89042032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).