5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine

C20H14N6 — CID 59137317

IUPAC5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine
SMILESc1ccc(-c2nc(-c3cnc4[nH]ncc4c3)c(-c3ccncc3)[nH]2)cc1
InChIInChI=1S/C20H14N6/c1-2-4-14(5-3-1)20-24-17(13-6-8-21-9-7-13)18(25-20)15-10-16-12-23-26-19(16)22-11-15/h1-12H,(H,24,25)(H,22,23,26)
InChIKeyPGUIXWLKVFUTED-UHFFFAOYSA-N
MW338.37 g/mol
LogP4.08
Rot. Bonds3

About 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine

5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine (PubChem CID 59137317) has the molecular formula C20H14N6 and a molecular weight of 338.37 g/mol. Its IUPAC name is 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine
PubChem CID59137317
Molecular FormulaC20H14N6
Molecular Weight338.37 g/mol
Exact Mass338.13
IUPAC Name5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine
SMILESc1ccc(-c2nc(-c3cnc4[nH]ncc4c3)c(-c3ccncc3)[nH]2)cc1
InChIInChI=1S/C20H14N6/c1-2-4-14(5-3-1)20-24-17(13-6-8-21-9-7-13)18(25-20)15-10-16-12-23-26-19(16)22-11-15/h1-12H,(H,24,25)(H,22,23,26)
InChIKeyPGUIXWLKVFUTED-UHFFFAOYSA-N
XLogP4.08
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine 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 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine (CID 59137317) is 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine is c1ccc(-c2nc(-c3cnc4[nH]ncc4c3)c(-c3ccncc3)[nH]2)cc1.
What is the InChIKey of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
The InChIKey is PGUIXWLKVFUTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N6/c1-2-4-14(5-3-1)20-24-17(13-6-8-21-9-7-13)18(25-20)15-10-16-12-23-26-19(16)22-11-15/h1-12H,(H,24,25)(H,22,23,26).
What are the key properties of 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine has a molecular weight of 338.37 g/mol, XLogP of 4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenyl-5-pyridin-4-yl-1H-imidazol-4-yl)-1H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 59137317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).