4-imidazo[1,2-a]pyridin-2-ylaniline

C13H11N3 — CID 696936

IUPAC4-imidazo[1,2-a]pyridin-2-ylaniline
SMILESNc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C13H11N3/c14-11-6-4-10(5-7-11)12-9-16-8-2-1-3-13(16)15-12/h1-9H,14H2
InChIKeyFPCHINCJTRAFAK-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.58
Rot. Bonds1

About 4-imidazo[1,2-a]pyridin-2-ylaniline

4-imidazo[1,2-a]pyridin-2-ylaniline (PubChem CID 696936) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-imidazo[1,2-a]pyridin-2-ylaniline.

Molecular Properties

Compound Name4-imidazo[1,2-a]pyridin-2-ylaniline
PubChem CID696936
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC Name4-imidazo[1,2-a]pyridin-2-ylaniline
SMILESNc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C13H11N3/c14-11-6-4-10(5-7-11)12-9-16-8-2-1-3-13(16)15-12/h1-9H,14H2
InChIKeyFPCHINCJTRAFAK-UHFFFAOYSA-N
XLogP2.58
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-imidazo[1,2-a]pyridin-2-ylaniline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-imidazo[1,2-a]pyridin-2-ylaniline?
The IUPAC name of 4-imidazo[1,2-a]pyridin-2-ylaniline (CID 696936) is 4-imidazo[1,2-a]pyridin-2-ylaniline.
What is the SMILES notation for 4-imidazo[1,2-a]pyridin-2-ylaniline?
The canonical SMILES for 4-imidazo[1,2-a]pyridin-2-ylaniline is Nc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of 4-imidazo[1,2-a]pyridin-2-ylaniline?
The InChIKey is FPCHINCJTRAFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c14-11-6-4-10(5-7-11)12-9-16-8-2-1-3-13(16)15-12/h1-9H,14H2.
What are the key properties of 4-imidazo[1,2-a]pyridin-2-ylaniline?
4-imidazo[1,2-a]pyridin-2-ylaniline has a molecular weight of 209.25 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazo[1,2-a]pyridin-2-ylaniline is sourced from PubChem (CID 696936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).