5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine

C13H11ClN4 — CID 24904003

IUPAC5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
SMILESCc1nc2ccc(Cl)nc2n1Cc1ccccn1
InChIInChI=1S/C13H11ClN4/c1-9-16-11-5-6-12(14)17-13(11)18(9)8-10-4-2-3-7-15-10/h2-7H,8H2,1H3
InChIKeyRBNKINUVIDLERU-UHFFFAOYSA-N
MW258.71 g/mol
LogP2.84
Rot. Bonds2

About 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine

5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine (PubChem CID 24904003) has the molecular formula C13H11ClN4 and a molecular weight of 258.71 g/mol. Its IUPAC name is 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
PubChem CID24904003
Molecular FormulaC13H11ClN4
Molecular Weight258.71 g/mol
Exact Mass258.07
IUPAC Name5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
SMILESCc1nc2ccc(Cl)nc2n1Cc1ccccn1
InChIInChI=1S/C13H11ClN4/c1-9-16-11-5-6-12(14)17-13(11)18(9)8-10-4-2-3-7-15-10/h2-7H,8H2,1H3
InChIKeyRBNKINUVIDLERU-UHFFFAOYSA-N
XLogP2.84
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine 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

4-[2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335883
5-chloro-2-methyl-3-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridine
CID 24904011
2-(1-chloroethyl)-5-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 81135521
ethane;6-fluoro-2-methyl-3-(pyridin-2-ylmethyl)quinazolin-4-one
CID 145212635
5-methoxy-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 115322105
2-(2-chloroethyl)-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 79289197
6-iodo-2-methyl-1-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 138522273
2-(2-chloroethyl)-5-methyl-3-(2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine
CID 81141067
6-bromo-2-methyl-1-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 138522628
1-[(2-chloro-3-pyridinyl)methyl]-2-methylbenzimidazole
CID 62470224
5-chloro-2-methyl-3-[[(3R)-oxolan-3-yl]methyl]imidazo[4,5-b]pyridine
CID 171838815
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine?
The IUPAC name of 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine (CID 24904003) is 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine is Cc1nc2ccc(Cl)nc2n1Cc1ccccn1.
What is the InChIKey of 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine?
The InChIKey is RBNKINUVIDLERU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN4/c1-9-16-11-5-6-12(14)17-13(11)18(9)8-10-4-2-3-7-15-10/h2-7H,8H2,1H3.
What are the key properties of 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine?
5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine has a molecular weight of 258.71 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methyl-3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 24904003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).