4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one

C24H18FN3O — CID 135620866

IUPAC4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
SMILESO=C1CC(c2ccc(F)cc2)c2c(-c3ccccc3)nn(-c3ccccc3)c2N1
InChIInChI=1S/C24H18FN3O/c25-18-13-11-16(12-14-18)20-15-21(29)26-24-22(20)23(17-7-3-1-4-8-17)27-28(24)19-9-5-2-6-10-19/h1-14,20H,15H2,(H,26,29)
InChIKeyARHGKJMPNKMPFG-UHFFFAOYSA-N
MW383.43 g/mol
LogP5.15
Rot. Bonds3

About 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one

4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one (PubChem CID 135620866) has the molecular formula C24H18FN3O and a molecular weight of 383.43 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
PubChem CID135620866
Molecular FormulaC24H18FN3O
Molecular Weight383.43 g/mol
Exact Mass383.14
IUPAC Name4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one
SMILESO=C1CC(c2ccc(F)cc2)c2c(-c3ccccc3)nn(-c3ccccc3)c2N1
InChIInChI=1S/C24H18FN3O/c25-18-13-11-16(12-14-18)20-15-21(29)26-24-22(20)23(17-7-3-1-4-8-17)27-28(24)19-9-5-2-6-10-19/h1-14,20H,15H2,(H,26,29)
InChIKeyARHGKJMPNKMPFG-UHFFFAOYSA-N
XLogP5.15
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.43
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The IUPAC name of 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one (CID 135620866) is 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one.
What is the SMILES notation for 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The canonical SMILES for 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one is O=C1CC(c2ccc(F)cc2)c2c(-c3ccccc3)nn(-c3ccccc3)c2N1.
What is the InChIKey of 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
The InChIKey is ARHGKJMPNKMPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O/c25-18-13-11-16(12-14-18)20-15-21(29)26-24-22(20)23(17-7-3-1-4-8-17)27-28(24)19-9-5-2-6-10-19/h1-14,20H,15H2,(H,26,29).
What are the key properties of 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one?
4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one has a molecular weight of 383.43 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1,3-diphenyl-5,7-dihydro-4H-pyrazolo[5,4-b]pyridin-6-one is sourced from PubChem (CID 135620866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).