2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile

C15H11FN4 — CID 82530319

IUPAC2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
SMILESN#CCc1c(-c2ccc(N)cc2)nc2ccc(F)cn12
InChIInChI=1S/C15H11FN4/c16-11-3-6-14-19-15(10-1-4-12(18)5-2-10)13(7-8-17)20(14)9-11/h1-6,9H,7,18H2
InChIKeyUEWTVRRNJJSMAS-UHFFFAOYSA-N
MW266.28 g/mol
LogP2.79
Rot. Bonds2

About 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile

2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile (PubChem CID 82530319) has the molecular formula C15H11FN4 and a molecular weight of 266.28 g/mol. Its IUPAC name is 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile.

Molecular Properties

Compound Name2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
PubChem CID82530319
Molecular FormulaC15H11FN4
Molecular Weight266.28 g/mol
Exact Mass266.10
IUPAC Name2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
SMILESN#CCc1c(-c2ccc(N)cc2)nc2ccc(F)cn12
InChIInChI=1S/C15H11FN4/c16-11-3-6-14-19-15(10-1-4-12(18)5-2-10)13(7-8-17)20(14)9-11/h1-6,9H,7,18H2
InChIKeyUEWTVRRNJJSMAS-UHFFFAOYSA-N
XLogP2.79
TPSA67.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(4-ethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060561
2-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 39133881
3-(chloromethyl)-6-fluoro-2-(4-fluorophenyl)imidazo[1,2-a]pyridine;hydrochloride
CID 67030270
2-[2-(2,4-dimethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060558
2-[6-bromo-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82030121
6-fluoro-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-amine
CID 63617964
2-[2-phenyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060793
[2-(4-tert-butylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]methanamine
CID 82060626
2-[6-fluoro-2-(4-fluoro-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82530532
2-(4-chlorophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-amine
CID 63616952
2-(4-bromophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-amine
CID 63617124
2-[6-amino-2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 93203589

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The IUPAC name of 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile (CID 82530319) is 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile.
What is the SMILES notation for 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The canonical SMILES for 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile is N#CCc1c(-c2ccc(N)cc2)nc2ccc(F)cn12.
What is the InChIKey of 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile?
The InChIKey is UEWTVRRNJJSMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4/c16-11-3-6-14-19-15(10-1-4-12(18)5-2-10)13(7-8-17)20(14)9-11/h1-6,9H,7,18H2.
What are the key properties of 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile?
2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile has a molecular weight of 266.28 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-aminophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile is sourced from PubChem (CID 82530319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).