3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde

C14H10N2O2 — CID 84736718

IUPAC3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde
SMILESO=Cc1ccn2c(-c3cccc(O)c3)ncc2c1
InChIInChI=1S/C14H10N2O2/c17-9-10-4-5-16-12(6-10)8-15-14(16)11-2-1-3-13(18)7-11/h1-9,18H
InChIKeyQIPYAECURGGTGG-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.52
Rot. Bonds2

About 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde

3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde (PubChem CID 84736718) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde.

Molecular Properties

Compound Name3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde
PubChem CID84736718
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde
SMILESO=Cc1ccn2c(-c3cccc(O)c3)ncc2c1
InChIInChI=1S/C14H10N2O2/c17-9-10-4-5-16-12(6-10)8-15-14(16)11-2-1-3-13(18)7-11/h1-9,18H
InChIKeyQIPYAECURGGTGG-UHFFFAOYSA-N
XLogP2.52
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde?
The IUPAC name of 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde (CID 84736718) is 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde.
What is the SMILES notation for 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde?
The canonical SMILES for 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde is O=Cc1ccn2c(-c3cccc(O)c3)ncc2c1.
What is the InChIKey of 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde?
The InChIKey is QIPYAECURGGTGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-9-10-4-5-16-12(6-10)8-15-14(16)11-2-1-3-13(18)7-11/h1-9,18H.
What are the key properties of 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde?
3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde has a molecular weight of 238.25 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-7-carbaldehyde is sourced from PubChem (CID 84736718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).