2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde

C15H12N2O2 — CID 43478005

IUPAC2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1cccc(Oc2nc3ccccn3c2C=O)c1
InChIInChI=1S/C15H12N2O2/c1-11-5-4-6-12(9-11)19-15-13(10-18)17-8-3-2-7-14(17)16-15/h2-10H,1H3
InChIKeyHXYITGLGTNHMHQ-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.25
Rot. Bonds3

About 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde

2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 43478005) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID43478005
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESCc1cccc(Oc2nc3ccccn3c2C=O)c1
InChIInChI=1S/C15H12N2O2/c1-11-5-4-6-12(9-11)19-15-13(10-18)17-8-3-2-7-14(17)16-15/h2-10H,1H3
InChIKeyHXYITGLGTNHMHQ-UHFFFAOYSA-N
XLogP3.25
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-ethoxyphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 62338465
2-(4-bromo-3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 83140955
2-(4-ethylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 43477988
2-(4-propan-2-ylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 43477979
2-(4-propylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 62548393
2-(2,4,5-trichlorophenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 43477950
N-methyl-1-[2-(3-methylphenoxy)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 43478688
2-(2-bromophenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 43477926
2-(2-bromo-4-methoxyphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 104707934
2-(2,5-dichlorophenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 43477975
2-[[2-(3-methylphenoxy)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]propanedinitrile
CID 3704634
2-(4-bromo-2-fluorophenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 43478038

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde (CID 43478005) is 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde is Cc1cccc(Oc2nc3ccccn3c2C=O)c1.
What is the InChIKey of 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is HXYITGLGTNHMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-11-5-4-6-12(9-11)19-15-13(10-18)17-8-3-2-7-14(17)16-15/h2-10H,1H3.
What are the key properties of 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde?
2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 252.27 g/mol, XLogP of 3.25, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)imidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 43478005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).