2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide

C22H16FN3O2 — CID 88906215

IUPAC2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(-c3cccc(C=O)c3)cc12
InChIInChI=1S/C22H16FN3O2/c1-24-22(28)20-19-12-17(16-4-2-3-14(11-16)13-27)9-10-26(19)25-21(20)15-5-7-18(23)8-6-15/h2-13H,1H3,(H,24,28)
InChIKeyLSHBXGJVSGJVRI-UHFFFAOYSA-N
MW373.39 g/mol
LogP3.98
Rot. Bonds4

About 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide

2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 88906215) has the molecular formula C22H16FN3O2 and a molecular weight of 373.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID88906215
Molecular FormulaC22H16FN3O2
Molecular Weight373.39 g/mol
Exact Mass373.12
IUPAC Name2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(-c3cccc(C=O)c3)cc12
InChIInChI=1S/C22H16FN3O2/c1-24-22(28)20-19-12-17(16-4-2-3-14(11-16)13-27)9-10-26(19)25-21(20)15-5-7-18(23)8-6-15/h2-13H,1H3,(H,24,28)
InChIKeyLSHBXGJVSGJVRI-UHFFFAOYSA-N
XLogP3.98
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide (CID 88906215) is 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide is CNC(=O)c1c(-c2ccc(F)cc2)nn2ccc(-c3cccc(C=O)c3)cc12.
What is the InChIKey of 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is LSHBXGJVSGJVRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16FN3O2/c1-24-22(28)20-19-12-17(16-4-2-3-14(11-16)13-27)9-10-26(19)25-21(20)15-5-7-18(23)8-6-15/h2-13H,1H3,(H,24,28).
What are the key properties of 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 373.39 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-(3-formylphenyl)-N-methylpyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 88906215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).