3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine

C21H20N4O3 — CID 150370331

IUPAC3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine
SMILESCOc1ccc(COc2ccc(Cn3cnc4cccnc43)cc2OC)cn1
InChIInChI=1S/C21H20N4O3/c1-26-19-10-15(12-25-14-24-17-4-3-9-22-21(17)25)5-7-18(19)28-13-16-6-8-20(27-2)23-11-16/h3-11,14H,12-13H2,1-2H3
InChIKeyGXPAHRCRYWMXQD-UHFFFAOYSA-N
MW376.42 g/mol
LogP3.47
Rot. Bonds7

About 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine

3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine (PubChem CID 150370331) has the molecular formula C21H20N4O3 and a molecular weight of 376.42 g/mol. Its IUPAC name is 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine
PubChem CID150370331
Molecular FormulaC21H20N4O3
Molecular Weight376.42 g/mol
Exact Mass376.15
IUPAC Name3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine
SMILESCOc1ccc(COc2ccc(Cn3cnc4cccnc43)cc2OC)cn1
InChIInChI=1S/C21H20N4O3/c1-26-19-10-15(12-25-14-24-17-4-3-9-22-21(17)25)5-7-18(19)28-13-16-6-8-20(27-2)23-11-16/h3-11,14H,12-13H2,1-2H3
InChIKeyGXPAHRCRYWMXQD-UHFFFAOYSA-N
XLogP3.47
TPSA71.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine?
The IUPAC name of 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine (CID 150370331) is 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine?
The canonical SMILES for 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine is COc1ccc(COc2ccc(Cn3cnc4cccnc43)cc2OC)cn1.
What is the InChIKey of 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine?
The InChIKey is GXPAHRCRYWMXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O3/c1-26-19-10-15(12-25-14-24-17-4-3-9-22-21(17)25)5-7-18(19)28-13-16-6-8-20(27-2)23-11-16/h3-11,14H,12-13H2,1-2H3.
What are the key properties of 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine?
3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine has a molecular weight of 376.42 g/mol, XLogP of 3.47, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methyl]imidazo[4,5-b]pyridine is sourced from PubChem (CID 150370331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).