3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine

C22H14F2N4 — CID 22031650

IUPAC3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4cccc(F)c4)n3c2)cc1
InChIInChI=1S/C22H14F2N4/c23-17-7-4-14(5-8-17)22-19(11-26-27-22)16-6-9-21-25-12-20(28(21)13-16)15-2-1-3-18(24)10-15/h1-13H,(H,26,27)
InChIKeyJINOWZNGTOPSPM-UHFFFAOYSA-N
MW372.38 g/mol
LogP5.34
Rot. Bonds3

About 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine

3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine (PubChem CID 22031650) has the molecular formula C22H14F2N4 and a molecular weight of 372.38 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
PubChem CID22031650
Molecular FormulaC22H14F2N4
Molecular Weight372.38 g/mol
Exact Mass372.12
IUPAC Name3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4cccc(F)c4)n3c2)cc1
InChIInChI=1S/C22H14F2N4/c23-17-7-4-14(5-8-17)22-19(11-26-27-22)16-6-9-21-25-12-20(28(21)13-16)15-2-1-3-18(24)10-15/h1-13H,(H,26,27)
InChIKeyJINOWZNGTOPSPM-UHFFFAOYSA-N
XLogP5.34
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.38
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine (CID 22031650) is 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine is Fc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4cccc(F)c4)n3c2)cc1.
What is the InChIKey of 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
The InChIKey is JINOWZNGTOPSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F2N4/c23-17-7-4-14(5-8-17)22-19(11-26-27-22)16-6-9-21-25-12-20(28(21)13-16)15-2-1-3-18(24)10-15/h1-13H,(H,26,27).
What are the key properties of 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine has a molecular weight of 372.38 g/mol, XLogP of 5.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 22031650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).