2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine

C22H20FN3O2 — CID 70648182

IUPAC2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine
SMILESCCOC(c1ccc(OCc2ccc(F)cc2)cc1)c1nc2ncccc2[nH]1
InChIInChI=1S/C22H20FN3O2/c1-2-27-20(22-25-19-4-3-13-24-21(19)26-22)16-7-11-18(12-8-16)28-14-15-5-9-17(23)10-6-15/h3-13,20H,2,14H2,1H3,(H,24,25,26)
InChIKeyHNVSGUIWFJMIPX-UHFFFAOYSA-N
MW377.42 g/mol
LogP4.80
Rot. Bonds7

About 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine

2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine (PubChem CID 70648182) has the molecular formula C22H20FN3O2 and a molecular weight of 377.42 g/mol. Its IUPAC name is 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine
PubChem CID70648182
Molecular FormulaC22H20FN3O2
Molecular Weight377.42 g/mol
Exact Mass377.15
IUPAC Name2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine
SMILESCCOC(c1ccc(OCc2ccc(F)cc2)cc1)c1nc2ncccc2[nH]1
InChIInChI=1S/C22H20FN3O2/c1-2-27-20(22-25-19-4-3-13-24-21(19)26-22)16-7-11-18(12-8-16)28-14-15-5-9-17(23)10-6-15/h3-13,20H,2,14H2,1H3,(H,24,25,26)
InChIKeyHNVSGUIWFJMIPX-UHFFFAOYSA-N
XLogP4.80
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-2-[ethoxy-[4-(pyridin-3-ylmethoxy)phenyl]methyl]-1H-benzimidazole
CID 70648166
6-fluoro-2-[1-[4-[(4-fluorophenyl)methoxy]phenyl]ethyl]-1H-imidazo[4,5-b]pyridine
CID 89433701
2-[[4-[(2,5-difluorophenyl)methoxy]phenyl]-ethoxymethyl]-6-(iodomethyl)-1H-benzimidazole
CID 89436472
6-chloro-2-[[4-[(2,5-difluorophenyl)methoxy]phenyl]-ethoxymethyl]-1H-benzimidazole
CID 54673270
2-[ethoxy-[4-(trifluoromethoxy)phenyl]methyl]-4-fluoro-1H-benzimidazole
CID 54672814
(6-fluoro-1H-imidazo[4,5-b]pyridin-2-yl)-[4-[(4-methylphenyl)methoxy]phenyl]methanol
CID 54673114
6-ethoxy-2-[1-[4-[(4-fluorophenyl)methoxy]phenyl]ethyl]-1H-benzimidazole
CID 89433744
1-(diethoxymethyl)-3-[(4-fluorophenyl)methoxy]benzene
CID 146004732
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366
1-fluoro-4-[[4-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]phenyl]methoxy]benzene
CID 129203352
2-[ethoxy-[4-(trifluoromethoxy)phenyl]methyl]-5,6-difluoro-1H-benzimidazole
CID 71294898
6-[(4-fluorophenyl)methoxy]quinoline
CID 60595158

Frequently Asked Questions

What is the IUPAC name of 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine (CID 70648182) is 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine is CCOC(c1ccc(OCc2ccc(F)cc2)cc1)c1nc2ncccc2[nH]1.
What is the InChIKey of 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine?
The InChIKey is HNVSGUIWFJMIPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O2/c1-2-27-20(22-25-19-4-3-13-24-21(19)26-22)16-7-11-18(12-8-16)28-14-15-5-9-17(23)10-6-15/h3-13,20H,2,14H2,1H3,(H,24,25,26).
What are the key properties of 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine?
2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine has a molecular weight of 377.42 g/mol, XLogP of 4.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethoxy-[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 70648182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).