4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine

C14H12ClN3O2 — CID 13175389

IUPAC4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine
SMILESCOc1ccc(-c2nc3c(Cl)nccc3[nH]2)c(OC)c1
InChIInChI=1S/C14H12ClN3O2/c1-19-8-3-4-9(11(7-8)20-2)14-17-10-5-6-16-13(15)12(10)18-14/h3-7H,1-2H3,(H,17,18)
InChIKeySSQASBLMKALSGB-UHFFFAOYSA-N
MW289.72 g/mol
LogP3.30
Rot. Bonds3

About 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine

4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine (PubChem CID 13175389) has the molecular formula C14H12ClN3O2 and a molecular weight of 289.72 g/mol. Its IUPAC name is 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine
PubChem CID13175389
Molecular FormulaC14H12ClN3O2
Molecular Weight289.72 g/mol
Exact Mass289.06
IUPAC Name4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine
SMILESCOc1ccc(-c2nc3c(Cl)nccc3[nH]2)c(OC)c1
InChIInChI=1S/C14H12ClN3O2/c1-19-8-3-4-9(11(7-8)20-2)14-17-10-5-6-16-13(15)12(10)18-14/h3-7H,1-2H3,(H,17,18)
InChIKeySSQASBLMKALSGB-UHFFFAOYSA-N
XLogP3.30
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine 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-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine (CID 13175389) is 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine is COc1ccc(-c2nc3c(Cl)nccc3[nH]2)c(OC)c1.
What is the InChIKey of 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine?
The InChIKey is SSQASBLMKALSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O2/c1-19-8-3-4-9(11(7-8)20-2)14-17-10-5-6-16-13(15)12(10)18-14/h3-7H,1-2H3,(H,17,18).
What are the key properties of 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine?
4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine has a molecular weight of 289.72 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2,4-dimethoxyphenyl)-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 13175389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).