6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine

C21H15N3O — CID 23025849

IUPAC6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine
SMILESc1coc(-c2cnc3nc(Cc4ccc5ccccc5c4)[nH]c3c2)c1
InChIInChI=1S/C21H15N3O/c1-2-5-16-10-14(7-8-15(16)4-1)11-20-23-18-12-17(13-22-21(18)24-20)19-6-3-9-25-19/h1-10,12-13H,11H2,(H,22,23,24)
InChIKeyDURMBCIGAOBAOZ-UHFFFAOYSA-N
MW325.37 g/mol
LogP4.96
Rot. Bonds3

About 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine

6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 23025849) has the molecular formula C21H15N3O and a molecular weight of 325.37 g/mol. Its IUPAC name is 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID23025849
Molecular FormulaC21H15N3O
Molecular Weight325.37 g/mol
Exact Mass325.12
IUPAC Name6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine
SMILESc1coc(-c2cnc3nc(Cc4ccc5ccccc5c4)[nH]c3c2)c1
InChIInChI=1S/C21H15N3O/c1-2-5-16-10-14(7-8-15(16)4-1)11-20-23-18-12-17(13-22-21(18)24-20)19-6-3-9-25-19/h1-10,12-13H,11H2,(H,22,23,24)
InChIKeyDURMBCIGAOBAOZ-UHFFFAOYSA-N
XLogP4.96
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine (CID 23025849) is 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine is c1coc(-c2cnc3nc(Cc4ccc5ccccc5c4)[nH]c3c2)c1.
What is the InChIKey of 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is DURMBCIGAOBAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3O/c1-2-5-16-10-14(7-8-15(16)4-1)11-20-23-18-12-17(13-22-21(18)24-20)19-6-3-9-25-19/h1-10,12-13H,11H2,(H,22,23,24).
What are the key properties of 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine?
6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 325.37 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-2-(naphthalen-2-ylmethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 23025849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).