4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine

C19H12F3N3 — CID 29090609

IUPAC4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine
SMILESFc1ccccc1-n1ncc2c(C(F)F)cc(-c3ccccc3)nc21
InChIInChI=1S/C19H12F3N3/c20-15-8-4-5-9-17(15)25-19-14(11-23-25)13(18(21)22)10-16(24-19)12-6-2-1-3-7-12/h1-11,18H
InChIKeyUKHQRMHEAYVVLE-UHFFFAOYSA-N
MW339.32 g/mol
LogP5.16
Rot. Bonds3

About 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine

4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine (PubChem CID 29090609) has the molecular formula C19H12F3N3 and a molecular weight of 339.32 g/mol. Its IUPAC name is 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine
PubChem CID29090609
Molecular FormulaC19H12F3N3
Molecular Weight339.32 g/mol
Exact Mass339.10
IUPAC Name4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine
SMILESFc1ccccc1-n1ncc2c(C(F)F)cc(-c3ccccc3)nc21
InChIInChI=1S/C19H12F3N3/c20-15-8-4-5-9-17(15)25-19-14(11-23-25)13(18(21)22)10-16(24-19)12-6-2-1-3-7-12/h1-11,18H
InChIKeyUKHQRMHEAYVVLE-UHFFFAOYSA-N
XLogP5.16
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.32
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-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 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine?
The IUPAC name of 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine (CID 29090609) is 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine.
What is the SMILES notation for 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine?
The canonical SMILES for 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine is Fc1ccccc1-n1ncc2c(C(F)F)cc(-c3ccccc3)nc21.
What is the InChIKey of 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine?
The InChIKey is UKHQRMHEAYVVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N3/c20-15-8-4-5-9-17(15)25-19-14(11-23-25)13(18(21)22)10-16(24-19)12-6-2-1-3-7-12/h1-11,18H.
What are the key properties of 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine?
4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine has a molecular weight of 339.32 g/mol, XLogP of 5.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-1-(2-fluorophenyl)-6-phenylpyrazolo[5,4-b]pyridine is sourced from PubChem (CID 29090609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).