2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

C15H13F3N4O — CID 10308608

IUPAC2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccnc(CCc2nc3ncc(C(F)(F)F)cc3[nH]2)c1
InChIInChI=1S/C15H13F3N4O/c1-23-11-4-5-19-10(7-11)2-3-13-21-12-6-9(15(16,17)18)8-20-14(12)22-13/h4-8H,2-3H2,1H3,(H,20,21,22)
InChIKeyHNPLBOKJCNYWIX-UHFFFAOYSA-N
MW322.29 g/mol
LogP3.17
Rot. Bonds4

About 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 10308608) has the molecular formula C15H13F3N4O and a molecular weight of 322.29 g/mol. Its IUPAC name is 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID10308608
Molecular FormulaC15H13F3N4O
Molecular Weight322.29 g/mol
Exact Mass322.10
IUPAC Name2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccnc(CCc2nc3ncc(C(F)(F)F)cc3[nH]2)c1
InChIInChI=1S/C15H13F3N4O/c1-23-11-4-5-19-10(7-11)2-3-13-21-12-6-9(15(16,17)18)8-20-14(12)22-13/h4-8H,2-3H2,1H3,(H,20,21,22)
InChIKeyHNPLBOKJCNYWIX-UHFFFAOYSA-N
XLogP3.17
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.29
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(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

4-[4-[2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridin-6-yl]phenyl]sulfonylmorpholine
CID 11202425
6-[4-[4-(2,6-dimethylphenyl)piperazin-1-yl]sulfonylphenyl]-2-[2-(4-methoxy-2-pyridinyl)ethyl]-1H-imidazo[4,5-b]pyridine
CID 11786587
2-[2-(4-methoxy-2-pyridinyl)ethyl]-7-[2-(2-methylphenyl)ethyl]-1H-imidazo[4,5-b]pyridine
CID 152617267
4-methoxy-2-propylpyridine
CID 11084054
6-phenyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]-1H-imidazo[4,5-b]pyridine
CID 23025563
6-methyl-2-(3,3,3-trifluoropropyl)-1H-imidazo[4,5-b]pyridine
CID 79796392
6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
CID 103208878
6-(furan-2-yl)-2-[2-(3,4,5-trimethoxyphenyl)ethyl]-1H-imidazo[4,5-b]pyridine
CID 23026021
2-[3-(2,2,2-trifluoroethoxy)-4-pyridinyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 158834270
N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-1-(4-methoxy-2-pyridinyl)-N-methylmethanamine
CID 134711439
2-methyl-1-[6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridin-2-yl]propan-1-amine
CID 102548896
[6-(methylamino)-3-pyridinyl]-[6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridin-2-yl]methanol
CID 142524995

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (CID 10308608) is 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is COc1ccnc(CCc2nc3ncc(C(F)(F)F)cc3[nH]2)c1.
What is the InChIKey of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is HNPLBOKJCNYWIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N4O/c1-23-11-4-5-19-10(7-11)2-3-13-21-12-6-9(15(16,17)18)8-20-14(12)22-13/h4-8H,2-3H2,1H3,(H,20,21,22).
What are the key properties of 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 322.29 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxy-2-pyridinyl)ethyl]-6-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 10308608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).