5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

C7H2Cl2F3N3 — CID 118988329

IUPAC5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESFC(F)(F)c1nc2nc(Cl)cc(Cl)c2[nH]1
InChIInChI=1S/C7H2Cl2F3N3/c8-2-1-3(9)13-5-4(2)14-6(15-5)7(10,11)12/h1H,(H,13,14,15)
InChIKeyKXPIQLFUTCCYCR-UHFFFAOYSA-N
MW256.01 g/mol
LogP3.28
Rot. Bonds

About 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 118988329) has the molecular formula C7H2Cl2F3N3 and a molecular weight of 256.01 g/mol. Its IUPAC name is 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID118988329
Molecular FormulaC7H2Cl2F3N3
Molecular Weight256.01 g/mol
Exact Mass254.96
IUPAC Name5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESFC(F)(F)c1nc2nc(Cl)cc(Cl)c2[nH]1
InChIInChI=1S/C7H2Cl2F3N3/c8-2-1-3(9)13-5-4(2)14-6(15-5)7(10,11)12/h1H,(H,13,14,15)
InChIKeyKXPIQLFUTCCYCR-UHFFFAOYSA-N
XLogP3.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.01
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5,7-dichloro-2-(trifluoromethyl)-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

5,7-dichloro-2-(4-chlorophenyl)-1H-imidazo[4,5-b]pyridine
CID 23037406
8-(trifluoromethyl)-7H-purin-6-amine
CID 3635406
3,4,6-trichloro-2-(trifluoromethyl)pyridine
CID 171506095
azanium 6-chloro-2-(trifluoromethyl)-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135624385
2,4,8-trichloro-6-(trifluoromethyl)quinoline
CID 156808230
6-(4-chlorophenyl)-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 86699532
6-methyl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 79015215
4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine
CID 118846674
4,6-dichloro-7-(3-chlorophenoxy)-2-(trifluoromethyl)-1H-benzimidazole
CID 154335639
7-bromo-6-chloro-2-(trifluoromethyl)-3H-quinazolin-4-one
CID 137178984
2-chloro-4-methyl-6-(trifluoromethyl)pyridine;ethane
CID 145468613
6-methyl-2-(trifluoromethyl)-3H-pyrido[2,3-d]pyrimidin-4-one
CID 137176452

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (CID 118988329) is 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is FC(F)(F)c1nc2nc(Cl)cc(Cl)c2[nH]1.
What is the InChIKey of 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is KXPIQLFUTCCYCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2Cl2F3N3/c8-2-1-3(9)13-5-4(2)14-6(15-5)7(10,11)12/h1H,(H,13,14,15).
What are the key properties of 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 256.01 g/mol, XLogP of 3.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 118988329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).