2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine

C16H16FN3O — CID 64855924

IUPAC2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESCc1ccc(F)c(Oc2nc3ccccn3c2CCN)c1
InChIInChI=1S/C16H16FN3O/c1-11-5-6-12(17)14(10-11)21-16-13(7-8-18)20-9-3-2-4-15(20)19-16/h2-6,9-10H,7-8,18H2,1H3
InChIKeyYHZZPHINJWTWPP-UHFFFAOYSA-N
MW285.32 g/mol
LogP3.08
Rot. Bonds4

About 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine

2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine (PubChem CID 64855924) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine
PubChem CID64855924
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC Name2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine
SMILESCc1ccc(F)c(Oc2nc3ccccn3c2CCN)c1
InChIInChI=1S/C16H16FN3O/c1-11-5-6-12(17)14(10-11)21-16-13(7-8-18)20-9-3-2-4-15(20)19-16/h2-6,9-10H,7-8,18H2,1H3
InChIKeyYHZZPHINJWTWPP-UHFFFAOYSA-N
XLogP3.08
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The IUPAC name of 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine (CID 64855924) is 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine.
What is the SMILES notation for 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The canonical SMILES for 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine is Cc1ccc(F)c(Oc2nc3ccccn3c2CCN)c1.
What is the InChIKey of 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
The InChIKey is YHZZPHINJWTWPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c1-11-5-6-12(17)14(10-11)21-16-13(7-8-18)20-9-3-2-4-15(20)19-16/h2-6,9-10H,7-8,18H2,1H3.
What are the key properties of 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine?
2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine has a molecular weight of 285.32 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluoro-5-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]ethanamine is sourced from PubChem (CID 64855924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).