3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine

C19H15N3 — CID 4671441

IUPAC3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine
SMILESCc1nn(-c2ccccc2)c2nc(-c3ccccc3)ccc12
InChIInChI=1S/C19H15N3/c1-14-17-12-13-18(15-8-4-2-5-9-15)20-19(17)22(21-14)16-10-6-3-7-11-16/h2-13H,1H3
InChIKeyOWKSSVUXUJDVCN-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.40
Rot. Bonds2

About 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine

3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine (PubChem CID 4671441) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine
PubChem CID4671441
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine
SMILESCc1nn(-c2ccccc2)c2nc(-c3ccccc3)ccc12
InChIInChI=1S/C19H15N3/c1-14-17-12-13-18(15-8-4-2-5-9-15)20-19(17)22(21-14)16-10-6-3-7-11-16/h2-13H,1H3
InChIKeyOWKSSVUXUJDVCN-UHFFFAOYSA-N
XLogP4.40
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine?
The IUPAC name of 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine (CID 4671441) is 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine.
What is the SMILES notation for 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine?
The canonical SMILES for 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine is Cc1nn(-c2ccccc2)c2nc(-c3ccccc3)ccc12.
What is the InChIKey of 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine?
The InChIKey is OWKSSVUXUJDVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3/c1-14-17-12-13-18(15-8-4-2-5-9-15)20-19(17)22(21-14)16-10-6-3-7-11-16/h2-13H,1H3.
What are the key properties of 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine?
3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine has a molecular weight of 285.35 g/mol, XLogP of 4.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,6-diphenylpyrazolo[5,4-b]pyridine is sourced from PubChem (CID 4671441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).