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

C23H14F4N4 — CID 22032568

IUPAC6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccccc4C(F)(F)F)n3c2)cc1
InChIInChI=1S/C23H14F4N4/c24-16-8-5-14(6-9-16)22-18(11-29-30-22)15-7-10-21-28-12-20(31(21)13-15)17-3-1-2-4-19(17)23(25,26)27/h1-13H,(H,29,30)
InChIKeyNOWFWJFOBVRWQF-UHFFFAOYSA-N
MW422.39 g/mol
LogP6.22
Rot. Bonds3

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

6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine (PubChem CID 22032568) has the molecular formula C23H14F4N4 and a molecular weight of 422.39 g/mol. Its IUPAC name is 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
PubChem CID22032568
Molecular FormulaC23H14F4N4
Molecular Weight422.39 g/mol
Exact Mass422.12
IUPAC Name6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine
SMILESFc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccccc4C(F)(F)F)n3c2)cc1
InChIInChI=1S/C23H14F4N4/c24-16-8-5-14(6-9-16)22-18(11-29-30-22)15-7-10-21-28-12-20(31(21)13-15)17-3-1-2-4-19(17)23(25,26)27/h1-13H,(H,29,30)
InChIKeyNOWFWJFOBVRWQF-UHFFFAOYSA-N
XLogP6.22
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.39
LogP ≤ 56.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine (CID 22032568) is 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine is Fc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4ccccc4C(F)(F)F)n3c2)cc1.
What is the InChIKey of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
The InChIKey is NOWFWJFOBVRWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14F4N4/c24-16-8-5-14(6-9-16)22-18(11-29-30-22)15-7-10-21-28-12-20(31(21)13-15)17-3-1-2-4-19(17)23(25,26)27/h1-13H,(H,29,30).
What are the key properties of 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine?
6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine has a molecular weight of 422.39 g/mol, XLogP of 6.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-3-[2-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 22032568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).