4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium

C9H8FN2+ — CID 69092720

IUPAC4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium
SMILESC=C[N+]12C=CN=C1C=C(F)C=C2
InChIInChI=1S/C9H8FN2/c1-2-12-5-3-8(10)7-9(12)11-4-6-12/h2-7H,1H2/q+1
InChIKeyOJTNUQGLBMAHNF-UHFFFAOYSA-N
MW163.17 g/mol
LogP2.21
Rot. Bonds1

About 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium

4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium (PubChem CID 69092720) has the molecular formula C9H8FN2+ and a molecular weight of 163.17 g/mol. Its IUPAC name is 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium.

Molecular Properties

Compound Name4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium
PubChem CID69092720
Molecular FormulaC9H8FN2+
Molecular Weight163.17 g/mol
Exact Mass163.07
IUPAC Name4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium
SMILESC=C[N+]12C=CN=C1C=C(F)C=C2
InChIInChI=1S/C9H8FN2/c1-2-12-5-3-8(10)7-9(12)11-4-6-12/h2-7H,1H2/q+1
InChIKeyOJTNUQGLBMAHNF-UHFFFAOYSA-N
XLogP2.21
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.17
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

Analyze 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-N-(2,2,2-trifluoroethyl)pyridin-2-imine;hydrobromide
CID 90654286
2h-Pyrido-[1,2-a]pyrimidine
CID 20222720
2,3-Dihydroimidazo[1,2-a]pyridine
CID 23423819
2H-imidazo[1,2-a]pyridin-4-ium
CID 23565484
Pyrido-[1,2-a]-1,3-diazepine
CID 129798958
1-ethenyl-5-fluoro-N-methylpyridin-2-imine
CID 68334595
(2R)-7-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703895
(2R)-3-fluoro-2-methyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703902
4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
CID 156652493
7-fluoro-4H-pyrido[1,2-a]pyrimidine
CID 169220442
6-chloro-3H-imidazo[1,2-a]pyridin-3-ide;palladium(2+);prop-1-ene
CID 134856117
1-methyl-N-(2,2,2-trifluoroethyl)pyridin-2-imine
CID 90654287

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium?
The IUPAC name of 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium (CID 69092720) is 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium.
What is the SMILES notation for 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium?
The canonical SMILES for 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium is C=C[N+]12C=CN=C1C=C(F)C=C2.
What is the InChIKey of 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium?
The InChIKey is OJTNUQGLBMAHNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN2/c1-2-12-5-3-8(10)7-9(12)11-4-6-12/h2-7H,1H2/q+1.
What are the key properties of 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium?
4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium has a molecular weight of 163.17 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-7-fluoroimidazo[1,2-a]pyridin-4-ium is sourced from PubChem (CID 69092720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).