2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine

C14H7F4N3O — CID 95967166

IUPAC2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine
SMILESO=Nc1c(-c2ccc(F)cc2)nc2ccc(C(F)(F)F)cn12
InChIInChI=1S/C14H7F4N3O/c15-10-4-1-8(2-5-10)12-13(20-22)21-7-9(14(16,17)18)3-6-11(21)19-12/h1-7H
InChIKeyRKGKGOACWFXSFF-UHFFFAOYSA-N
MW309.22 g/mol
LogP4.56
Rot. Bonds2

About 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine

2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine (PubChem CID 95967166) has the molecular formula C14H7F4N3O and a molecular weight of 309.22 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine
PubChem CID95967166
Molecular FormulaC14H7F4N3O
Molecular Weight309.22 g/mol
Exact Mass309.05
IUPAC Name2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine
SMILESO=Nc1c(-c2ccc(F)cc2)nc2ccc(C(F)(F)F)cn12
InChIInChI=1S/C14H7F4N3O/c15-10-4-1-8(2-5-10)12-13(20-22)21-7-9(14(16,17)18)3-6-11(21)19-12/h1-7H
InChIKeyRKGKGOACWFXSFF-UHFFFAOYSA-N
XLogP4.56
TPSA46.73 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.22
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine (CID 95967166) is 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine is O=Nc1c(-c2ccc(F)cc2)nc2ccc(C(F)(F)F)cn12.
What is the InChIKey of 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine?
The InChIKey is RKGKGOACWFXSFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7F4N3O/c15-10-4-1-8(2-5-10)12-13(20-22)21-7-9(14(16,17)18)3-6-11(21)19-12/h1-7H.
What are the key properties of 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine?
2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine has a molecular weight of 309.22 g/mol, XLogP of 4.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 95967166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).