3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine

C18H12F3N5O2 — CID 53250789

IUPAC3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine
SMILESCOc1ccc(-n2c(-c3ccccn3)nc3cc(OC(F)(F)F)cnc32)cn1
InChIInChI=1S/C18H12F3N5O2/c1-27-15-6-5-11(9-23-15)26-16-14(8-12(10-24-16)28-18(19,20)21)25-17(26)13-4-2-3-7-22-13/h2-10H,1H3
InChIKeyCUQJTHKUDVKQIQ-UHFFFAOYSA-N
MW387.32 g/mol
LogP3.78
Rot. Bonds4

About 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine

3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine (PubChem CID 53250789) has the molecular formula C18H12F3N5O2 and a molecular weight of 387.32 g/mol. Its IUPAC name is 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine
PubChem CID53250789
Molecular FormulaC18H12F3N5O2
Molecular Weight387.32 g/mol
Exact Mass387.09
IUPAC Name3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine
SMILESCOc1ccc(-n2c(-c3ccccn3)nc3cc(OC(F)(F)F)cnc32)cn1
InChIInChI=1S/C18H12F3N5O2/c1-27-15-6-5-11(9-23-15)26-16-14(8-12(10-24-16)28-18(19,20)21)25-17(26)13-4-2-3-7-22-13/h2-10H,1H3
InChIKeyCUQJTHKUDVKQIQ-UHFFFAOYSA-N
XLogP3.78
TPSA74.95 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.32
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)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

Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine?
The IUPAC name of 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine (CID 53250789) is 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine is COc1ccc(-n2c(-c3ccccn3)nc3cc(OC(F)(F)F)cnc32)cn1.
What is the InChIKey of 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine?
The InChIKey is CUQJTHKUDVKQIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3N5O2/c1-27-15-6-5-11(9-23-15)26-16-14(8-12(10-24-16)28-18(19,20)21)25-17(26)13-4-2-3-7-22-13/h2-10H,1H3.
What are the key properties of 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine?
3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine has a molecular weight of 387.32 g/mol, XLogP of 3.78, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-3-pyridinyl)-2-pyridin-2-yl-6-(trifluoromethoxy)imidazo[4,5-b]pyridine is sourced from PubChem (CID 53250789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).