2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile

C17H14FN3 — CID 82029983

IUPAC2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
SMILESCc1ccc2nc(-c3ccc(F)cc3)c(C(C)C#N)n2c1
InChIInChI=1S/C17H14FN3/c1-11-3-8-15-20-16(13-4-6-14(18)7-5-13)17(12(2)9-19)21(15)10-11/h3-8,10,12H,1-2H3
InChIKeyGPYGAPXOFQZTII-UHFFFAOYSA-N
MW279.32 g/mol
LogP4.08
Rot. Bonds2

About 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile

2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile (PubChem CID 82029983) has the molecular formula C17H14FN3 and a molecular weight of 279.32 g/mol. Its IUPAC name is 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile.

Molecular Properties

Compound Name2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
PubChem CID82029983
Molecular FormulaC17H14FN3
Molecular Weight279.32 g/mol
Exact Mass279.12
IUPAC Name2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
SMILESCc1ccc2nc(-c3ccc(F)cc3)c(C(C)C#N)n2c1
InChIInChI=1S/C17H14FN3/c1-11-3-8-15-20-16(13-4-6-14(18)7-5-13)17(12(2)9-19)21(15)10-11/h3-8,10,12H,1-2H3
InChIKeyGPYGAPXOFQZTII-UHFFFAOYSA-N
XLogP4.08
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanenitrile
CID 82029976
1-[6-fluoro-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]ethanol
CID 82530419
3-(1-chloroethyl)-2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyridine
CID 82029817
3-(chloromethyl)-2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridine;hydrochloride
CID 67028789
1-[6-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanol
CID 82029395
3,6-dimethyl-2-(4-methylphenyl)imidazo[1,2-a]pyridine;hydrobromide
CID 102552999
2-[7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82030006
3-(1-chloroethyl)-2-(4-ethylphenyl)-6-methylimidazo[1,2-a]pyridine
CID 82029815
2-[2-(1,3-benzodioxol-5-yl)-6-chloroimidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82030074
2-[6-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-yl)imidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82030062
4,6-difluoro-N-[[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methyl]pyrimidin-2-amine
CID 67028731
2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82030016

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
The IUPAC name of 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile (CID 82029983) is 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile.
What is the SMILES notation for 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
The canonical SMILES for 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile is Cc1ccc2nc(-c3ccc(F)cc3)c(C(C)C#N)n2c1.
What is the InChIKey of 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
The InChIKey is GPYGAPXOFQZTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3/c1-11-3-8-15-20-16(13-4-6-14(18)7-5-13)17(12(2)9-19)21(15)10-11/h3-8,10,12H,1-2H3.
What are the key properties of 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile has a molecular weight of 279.32 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile is sourced from PubChem (CID 82029983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).