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

C17H10F4N4 — CID 22032301

IUPAC3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2cnc3ccc(-c4cn[nH]c4C(F)(F)F)cn23)cc1
InChIInChI=1S/C17H10F4N4/c18-12-4-1-10(2-5-12)14-8-22-15-6-3-11(9-25(14)15)13-7-23-24-16(13)17(19,20)21/h1-9H,(H,23,24)
InChIKeyWVAXNHWYKDMAAH-UHFFFAOYSA-N
MW346.29 g/mol
LogP4.55
Rot. Bonds2

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

3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine (PubChem CID 22032301) has the molecular formula C17H10F4N4 and a molecular weight of 346.29 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
PubChem CID22032301
Molecular FormulaC17H10F4N4
Molecular Weight346.29 g/mol
Exact Mass346.08
IUPAC Name3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2cnc3ccc(-c4cn[nH]c4C(F)(F)F)cn23)cc1
InChIInChI=1S/C17H10F4N4/c18-12-4-1-10(2-5-12)14-8-22-15-6-3-11(9-25(14)15)13-7-23-24-16(13)17(19,20)21/h1-9H,(H,23,24)
InChIKeyWVAXNHWYKDMAAH-UHFFFAOYSA-N
XLogP4.55
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.29
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine (CID 22032301) is 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine is Fc1ccc(-c2cnc3ccc(-c4cn[nH]c4C(F)(F)F)cn23)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
The InChIKey is WVAXNHWYKDMAAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F4N4/c18-12-4-1-10(2-5-12)14-8-22-15-6-3-11(9-25(14)15)13-7-23-24-16(13)17(19,20)21/h1-9H,(H,23,24).
What are the key properties of 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine?
3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine has a molecular weight of 346.29 g/mol, XLogP of 4.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-6-[5-(trifluoromethyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 22032301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).