5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine

C13H15Cl2N3 — CID 103977441

IUPAC5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine
SMILESCC1(C)C(c2nc3nc(Cl)c(Cl)cc3[nH]2)C1(C)C
InChIInChI=1S/C13H15Cl2N3/c1-12(2)8(13(12,3)4)11-16-7-5-6(14)9(15)17-10(7)18-11/h5,8H,1-4H3,(H,16,17,18)
InChIKeyBPBRRZOXFXOSKZ-UHFFFAOYSA-N
MW284.19 g/mol
LogP4.41
Rot. Bonds1

About 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine

5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 103977441) has the molecular formula C13H15Cl2N3 and a molecular weight of 284.19 g/mol. Its IUPAC name is 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine
PubChem CID103977441
Molecular FormulaC13H15Cl2N3
Molecular Weight284.19 g/mol
Exact Mass283.06
IUPAC Name5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine
SMILESCC1(C)C(c2nc3nc(Cl)c(Cl)cc3[nH]2)C1(C)C
InChIInChI=1S/C13H15Cl2N3/c1-12(2)8(13(12,3)4)11-16-7-5-6(14)9(15)17-10(7)18-11/h5,8H,1-4H3,(H,16,17,18)
InChIKeyBPBRRZOXFXOSKZ-UHFFFAOYSA-N
XLogP4.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-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

2,6-Dimethyl-8-ethyl-1-deazapurine
CID 9815374
5,6-dichloro-2-cyclopropyl-1H-benzimidazole
CID 39158426
5,6-dichloro-2-pentan-2-yl-1H-benzimidazole
CID 21847235
5,7-dichloro-1H-imidazo[4,5-b]pyridine
CID 5949802
5-chloro-2-(trifluoromethyl)-3H-imidazo[4,5-b]pyridine
CID 13118322
4-chloro-2,6-dimethyl-5H-pyrrolo[3,2-d]pyrimidine
CID 18511061
5-chloro-2-(chloromethyl)-3H-imidazo[4,5-b]pyridine
CID 21919249
5,6-dichloro-3H-imidazo(4,5-b)pyridine
CID 53438932
5,6-dichloro-2-pentan-3-yl-1H-benzimidazole
CID 36047440
2-butan-2-yl-5,6-dichloro-1H-benzimidazole
CID 44439483
4,6-dichloro-2-(chloromethyl)-1H-imidazo(4,5-c)pyridine
CID 165978756
5-chloro-2-(trichloromethyl)-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 14126939

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine (CID 103977441) is 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine is CC1(C)C(c2nc3nc(Cl)c(Cl)cc3[nH]2)C1(C)C.
What is the InChIKey of 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is BPBRRZOXFXOSKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3/c1-12(2)8(13(12,3)4)11-16-7-5-6(14)9(15)17-10(7)18-11/h5,8H,1-4H3,(H,16,17,18).
What are the key properties of 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine?
5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 284.19 g/mol, XLogP of 4.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-2-(2,2,3,3-tetramethylcyclopropyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 103977441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).