4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde

C8H10N2O — CID 83872460

IUPAC4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde
SMILESO=CC1CCc2ccnn2C1
InChIInChI=1S/C8H10N2O/c11-6-7-1-2-8-3-4-9-10(8)5-7/h3-4,6-7H,1-2,5H2
InChIKeyPXGXZEYWVXBDIT-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.64
Rot. Bonds1

About 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde

4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde (PubChem CID 83872460) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde.

Molecular Properties

Compound Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde
PubChem CID83872460
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde
SMILESO=CC1CCc2ccnn2C1
InChIInChI=1S/C8H10N2O/c11-6-7-1-2-8-3-4-9-10(8)5-7/h3-4,6-7H,1-2,5H2
InChIKeyPXGXZEYWVXBDIT-UHFFFAOYSA-N
XLogP0.64
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde?
The IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde (CID 83872460) is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde.
What is the SMILES notation for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde?
The canonical SMILES for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde is O=CC1CCc2ccnn2C1.
What is the InChIKey of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde?
The InChIKey is PXGXZEYWVXBDIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c11-6-7-1-2-8-3-4-9-10(8)5-7/h3-4,6-7H,1-2,5H2.
What are the key properties of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde?
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde has a molecular weight of 150.18 g/mol, XLogP of 0.64, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-6-carbaldehyde is sourced from PubChem (CID 83872460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).