[1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone

C20H14FN3O2 — CID 154760615

IUPAC[1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone
SMILESCc1nn(-c2ccc(F)cc2)c2ncc(C(=O)c3ccccc3O)cc12
InChIInChI=1S/C20H14FN3O2/c1-12-17-10-13(19(26)16-4-2-3-5-18(16)25)11-22-20(17)24(23-12)15-8-6-14(21)7-9-15/h2-11,25H,1H3
InChIKeyUXLGTGHNTFHAGN-UHFFFAOYSA-N
MW347.35 g/mol
LogP3.80
Rot. Bonds3

About [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone

[1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone (PubChem CID 154760615) has the molecular formula C20H14FN3O2 and a molecular weight of 347.35 g/mol. Its IUPAC name is [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone
PubChem CID154760615
Molecular FormulaC20H14FN3O2
Molecular Weight347.35 g/mol
Exact Mass347.11
IUPAC Name[1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone
SMILESCc1nn(-c2ccc(F)cc2)c2ncc(C(=O)c3ccccc3O)cc12
InChIInChI=1S/C20H14FN3O2/c1-12-17-10-13(19(26)16-4-2-3-5-18(16)25)11-22-20(17)24(23-12)15-8-6-14(21)7-9-15/h2-11,25H,1H3
InChIKeyUXLGTGHNTFHAGN-UHFFFAOYSA-N
XLogP3.80
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.35
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone 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 [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone?
The IUPAC name of [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone (CID 154760615) is [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone.
What is the SMILES notation for [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone?
The canonical SMILES for [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone is Cc1nn(-c2ccc(F)cc2)c2ncc(C(=O)c3ccccc3O)cc12.
What is the InChIKey of [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone?
The InChIKey is UXLGTGHNTFHAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O2/c1-12-17-10-13(19(26)16-4-2-3-5-18(16)25)11-22-20(17)24(23-12)15-8-6-14(21)7-9-15/h2-11,25H,1H3.
What are the key properties of [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone?
[1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone has a molecular weight of 347.35 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)-3-methylpyrazolo[5,4-b]pyridin-5-yl]-(2-hydroxyphenyl)methanone is sourced from PubChem (CID 154760615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).