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

C13H6Cl2F3N3 — CID 103977488

IUPAC5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESFC(F)(F)c1ccccc1-c1nc2nc(Cl)c(Cl)cc2[nH]1
InChIInChI=1S/C13H6Cl2F3N3/c14-8-5-9-12(20-10(8)15)21-11(19-9)6-3-1-2-4-7(6)13(16,17)18/h1-5H,(H,19,20,21)
InChIKeyWRZKXFGBPQZHMI-UHFFFAOYSA-N
MW332.11 g/mol
LogP4.95
Rot. Bonds1

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

5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 103977488) has the molecular formula C13H6Cl2F3N3 and a molecular weight of 332.11 g/mol. Its IUPAC name is 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine
PubChem CID103977488
Molecular FormulaC13H6Cl2F3N3
Molecular Weight332.11 g/mol
Exact Mass330.99
IUPAC Name5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine
SMILESFC(F)(F)c1ccccc1-c1nc2nc(Cl)c(Cl)cc2[nH]1
InChIInChI=1S/C13H6Cl2F3N3/c14-8-5-9-12(20-10(8)15)21-11(19-9)6-3-1-2-4-7(6)13(16,17)18/h1-5H,(H,19,20,21)
InChIKeyWRZKXFGBPQZHMI-UHFFFAOYSA-N
XLogP4.95
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.11
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5,6-dichloro-2-(2,5-dichlorothiophen-3-yl)-1H-imidazo[4,5-b]pyridine
CID 114021455
5,6-dichloro-2-(4-propan-2-ylphenyl)-1H-imidazo[4,5-b]pyridine
CID 103977550
4,6-dimethyl-2-[2-(trifluoromethyl)phenyl]-1H-benzimidazole
CID 82940862
5,6-dichloro-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
CID 103208916
2,3-dichloro-5-[2-(trifluoromethyl)phenyl]pyridine
CID 118815216
8-[2-(trifluoromethyl)phenyl]-7H-purin-6-amine
CID 114608201
5,6-dichloro-2-(phenoxymethyl)-1H-imidazo[4,5-b]pyridine
CID 103977363
N-hydroxy-2-[2-(trifluoromethyl)phenyl]-3H-benzimidazole-5-carboxamide
CID 122690152
4-chloro-2,3-dimethyl-6-[2-(trifluoromethyl)phenyl]pyridine
CID 123435575
2-(5-tert-butyl-4-chloro-2-methylpyrazol-3-yl)-5-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine;hydrochloride
CID 137253019
2-(3-chloronaphthalen-2-yl)-5-methoxy-1H-imidazo[4,5-b]pyridine
CID 70461397
6-chloro-2-[2-(trifluoromethyl)phenyl]-1H-pyrrolo[3,2-c]pyridine
CID 146326550

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine (CID 103977488) is 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine is FC(F)(F)c1ccccc1-c1nc2nc(Cl)c(Cl)cc2[nH]1.
What is the InChIKey of 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is WRZKXFGBPQZHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H6Cl2F3N3/c14-8-5-9-12(20-10(8)15)21-11(19-9)6-3-1-2-4-7(6)13(16,17)18/h1-5H,(H,19,20,21).
What are the key properties of 5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine?
5,6-dichloro-2-[2-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 332.11 g/mol, XLogP of 4.95, 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-(trifluoromethyl)phenyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 103977488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).