3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid

C15H12N2O3 — CID 117147680

IUPAC3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid
SMILESO=C(O)c1cccn2c(Cc3cccc(O)c3)ncc12
InChIInChI=1S/C15H12N2O3/c18-11-4-1-3-10(7-11)8-14-16-9-13-12(15(19)20)5-2-6-17(13)14/h1-7,9,18H,8H2,(H,19,20)
InChIKeyOOPOHQQCSHZAGU-UHFFFAOYSA-N
MW268.27 g/mol
LogP2.33
Rot. Bonds3

About 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid

3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 117147680) has the molecular formula C15H12N2O3 and a molecular weight of 268.27 g/mol. Its IUPAC name is 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid
PubChem CID117147680
Molecular FormulaC15H12N2O3
Molecular Weight268.27 g/mol
Exact Mass268.08
IUPAC Name3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid
SMILESO=C(O)c1cccn2c(Cc3cccc(O)c3)ncc12
InChIInChI=1S/C15H12N2O3/c18-11-4-1-3-10(7-11)8-14-16-9-13-12(15(19)20)5-2-6-17(13)14/h1-7,9,18H,8H2,(H,19,20)
InChIKeyOOPOHQQCSHZAGU-UHFFFAOYSA-N
XLogP2.33
TPSA74.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(8-chloroimidazo[1,5-a]pyridin-3-yl)methyl]phenol
CID 117146925
3-ethylimidazo[1,5-a]pyridine-8-carboxylic acid
CID 83829474
3-(2-piperidin-1-ylethyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117147787
3-chloroimidazo[1,5-a]pyridine-8-carboxylic acid
CID 83831277
3-(pyrrolidin-3-ylmethyl)imidazo[1,5-a]pyridine-8-carboxylic acid
CID 117147434
3-[(3-chlorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxylic acid
CID 117147677
1-(3-ethylimidazo[1,5-a]pyridin-8-yl)ethanone
CID 83876950
3-[(3-hydroxyphenoxy)methyl]imidazo[1,2-a]pyridine-8-carboxylic acid
CID 117256906
3-[(4-bromophenyl)methyl]imidazo[1,5-a]pyridin-8-ol
CID 117147027
3-[(3-hydroxyphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
CID 62388791
4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol
CID 117145848
3-[(5-aminoimidazo[1,5-a]pyridin-3-yl)methyl]phenol
CID 117141968

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid (CID 117147680) is 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid is O=C(O)c1cccn2c(Cc3cccc(O)c3)ncc12.
What is the InChIKey of 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is OOPOHQQCSHZAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O3/c18-11-4-1-3-10(7-11)8-14-16-9-13-12(15(19)20)5-2-6-17(13)14/h1-7,9,18H,8H2,(H,19,20).
What are the key properties of 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid?
3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 268.27 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxyphenyl)methyl]imidazo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 117147680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).