3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid

C15H11FN2O3 — CID 117256022

IUPAC3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2ncc(COc3ccc(F)cc3)n12
InChIInChI=1S/C15H11FN2O3/c16-10-4-6-12(7-5-10)21-9-11-8-17-14-3-1-2-13(15(19)20)18(11)14/h1-8H,9H2,(H,19,20)
InChIKeyGMWMQJQBDZPIFU-UHFFFAOYSA-N
MW286.26 g/mol
LogP2.75
Rot. Bonds4

About 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid

3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid (PubChem CID 117256022) has the molecular formula C15H11FN2O3 and a molecular weight of 286.26 g/mol. Its IUPAC name is 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
PubChem CID117256022
Molecular FormulaC15H11FN2O3
Molecular Weight286.26 g/mol
Exact Mass286.08
IUPAC Name3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2ncc(COc3ccc(F)cc3)n12
InChIInChI=1S/C15H11FN2O3/c16-10-4-6-12(7-5-10)21-9-11-8-17-14-3-1-2-13(15(19)20)18(11)14/h1-8H,9H2,(H,19,20)
InChIKeyGMWMQJQBDZPIFU-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
methyl 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-6-carboxylate
CID 117256294
1-ethyl-5-[(4-fluorophenoxy)methyl]pyrazole-3-carboxylic acid
CID 117217340
2-[(3-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117255822
2-[(3-fluorophenoxy)methyl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 117257662
1-ethyl-2-[(4-fluorophenoxy)methyl]indole-4-carboxylic acid
CID 117174116
2-[(4-fluorophenoxy)methyl]-[1,2,4]triazolo[1,5-a]pyridine-6-carboxylic acid
CID 117257810
2-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 117257671
5-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 76849588
5-[(4-fluorophenoxy)methyl]-1,2-oxazole-4-carboxylic acid
CID 117217458
5-[(4-fluorophenoxy)methyl]pyridine-3-carboxylic acid
CID 117212713
2-[(4-fluorophenoxy)methyl]-6-oxo-1H-pyrimidine-5-carboxylic acid
CID 82168297

Frequently Asked Questions

What is the IUPAC name of 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The IUPAC name of 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid (CID 117256022) is 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The canonical SMILES for 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid is O=C(O)c1cccc2ncc(COc3ccc(F)cc3)n12.
What is the InChIKey of 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
The InChIKey is GMWMQJQBDZPIFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O3/c16-10-4-6-12(7-5-10)21-9-11-8-17-14-3-1-2-13(15(19)20)18(11)14/h1-8H,9H2,(H,19,20).
What are the key properties of 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid?
3-[(4-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 3-[(4-fluorophenoxy)methyl]imidazo[1,2-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 117256022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).