2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid

C15H12N2O3 — CID 82146579

IUPAC2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid
SMILESO=C(O)c1ccccc1COc1cccn2ccnc12
InChIInChI=1S/C15H12N2O3/c18-15(19)12-5-2-1-4-11(12)10-20-13-6-3-8-17-9-7-16-14(13)17/h1-9H,10H2,(H,18,19)
InChIKeyJUWVWOBAHXCVAI-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.61
Rot. Bonds4

About 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid

2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid (PubChem CID 82146579) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid.

Molecular Properties

Compound Name2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid
PubChem CID82146579
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid
SMILESO=C(O)c1ccccc1COc1cccn2ccnc12
InChIInChI=1S/C15H12N2O3/c18-15(19)12-5-2-1-4-11(12)10-20-13-6-3-8-17-9-7-16-14(13)17/h1-9H,10H2,(H,18,19)
InChIKeyJUWVWOBAHXCVAI-UHFFFAOYSA-N
XLogP2.61
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

imidazo[1,2-a]pyridine-8-carboxylic acid
CID 11715357
2-[(2-ethylphenoxy)methyl]benzoic acid
CID 20987953
2-(naphthalen-1-yloxymethyl)benzoic acid
CID 43473128
2-[(2-methoxycarbonylphenoxy)methyl]benzoic acid
CID 70197769
2-[(2-propan-2-ylphenoxy)methyl]benzoic acid
CID 20987862
2-[(2-chlorophenoxy)methyl]imidazo[1,2-a]pyridine-8-carboxylic acid
CID 117256740
2-(pyrimidin-2-ylmethoxy)benzoic acid
CID 62698186
2-[(2-fluorophenyl)methoxy]benzoic acid
CID 8707038
4-[(2-methoxyphenoxy)methyl]pyridine-3-carboxylic acid
CID 117212644
imidazo[1,2-a]pyridin-8-yloxyboronic acid
CID 153409442
acetic acid;2-(phenoxymethyl)benzoic acid
CID 154809758
2-[(2-benzylphenyl)methoxy]benzoic acid
CID 22362973

Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid?
The IUPAC name of 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid (CID 82146579) is 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid.
What is the SMILES notation for 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid?
The canonical SMILES for 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid is O=C(O)c1ccccc1COc1cccn2ccnc12.
What is the InChIKey of 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid?
The InChIKey is JUWVWOBAHXCVAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c18-15(19)12-5-2-1-4-11(12)10-20-13-6-3-8-17-9-7-16-14(13)17/h1-9H,10H2,(H,18,19).
What are the key properties of 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid?
2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid has a molecular weight of 268.27 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[1,2-a]pyridin-8-yloxymethyl)benzoic acid is sourced from PubChem (CID 82146579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).