2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid

C15H11FN2O3 — CID 117255822

IUPAC2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2nc(COc3cccc(F)c3)cn12
InChIInChI=1S/C15H11FN2O3/c16-10-3-1-4-12(7-10)21-9-11-8-18-13(15(19)20)5-2-6-14(18)17-11/h1-8H,9H2,(H,19,20)
InChIKeyXXFMYWNFZICCJQ-UHFFFAOYSA-N
MW286.26 g/mol
LogP2.75
Rot. Bonds4

About 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid

2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid (PubChem CID 117255822) has the molecular formula C15H11FN2O3 and a molecular weight of 286.26 g/mol. Its IUPAC name is 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
PubChem CID117255822
Molecular FormulaC15H11FN2O3
Molecular Weight286.26 g/mol
Exact Mass286.08
IUPAC Name2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2nc(COc3cccc(F)c3)cn12
InChIInChI=1S/C15H11FN2O3/c16-10-3-1-4-12(7-10)21-9-11-8-18-13(15(19)20)5-2-6-14(18)17-11/h1-8H,9H2,(H,19,20)
InChIKeyXXFMYWNFZICCJQ-UHFFFAOYSA-N
XLogP2.75
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.26
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117255832
2-[(3-fluorophenoxy)methyl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 117257662
methyl 2-[(3-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255825
methyl 2-[(4-methoxyphenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylate
CID 117255839
3-[(3-fluorophenoxy)methyl]-1,2-oxazole-5-carboxylic acid
CID 117215650
methyl 2-[(3-fluorophenoxy)methyl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
CID 117257664
3-[(3-fluorophenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine-7-carboxylic acid
CID 117257338
2-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridin-5-amine
CID 117255760
2-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117255796
2-[(cyclobutylamino)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117255785
2-[(3-chlorophenyl)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117132642
4-[(3-hydroxyphenoxy)methyl]-1-methylimidazole-2-carboxylic acid
CID 117191697

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The IUPAC name of 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid (CID 117255822) is 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The canonical SMILES for 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid is O=C(O)c1cccc2nc(COc3cccc(F)c3)cn12.
What is the InChIKey of 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The InChIKey is XXFMYWNFZICCJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O3/c16-10-3-1-4-12(7-10)21-9-11-8-18-13(15(19)20)5-2-6-14(18)17-11/h1-8H,9H2,(H,19,20).
What are the key properties of 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid has a molecular weight of 286.26 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 117255822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).