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

C17H13N3O — CID 23025562

IUPAC2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine
SMILESc1ccc(Cc2nc3ncc(-c4ccco4)cc3[nH]2)cc1
InChIInChI=1S/C17H13N3O/c1-2-5-12(6-3-1)9-16-19-14-10-13(11-18-17(14)20-16)15-7-4-8-21-15/h1-8,10-11H,9H2,(H,18,19,20)
InChIKeyRCCXHHQDCCDZKW-UHFFFAOYSA-N
MW275.31 g/mol
LogP3.81
Rot. Bonds3

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

2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 23025562) has the molecular formula C17H13N3O and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID23025562
Molecular FormulaC17H13N3O
Molecular Weight275.31 g/mol
Exact Mass275.11
IUPAC Name2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine
SMILESc1ccc(Cc2nc3ncc(-c4ccco4)cc3[nH]2)cc1
InChIInChI=1S/C17H13N3O/c1-2-5-12(6-3-1)9-16-19-14-10-13(11-18-17(14)20-16)15-7-4-8-21-15/h1-8,10-11H,9H2,(H,18,19,20)
InChIKeyRCCXHHQDCCDZKW-UHFFFAOYSA-N
XLogP3.81
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine (CID 23025562) is 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine is c1ccc(Cc2nc3ncc(-c4ccco4)cc3[nH]2)cc1.
What is the InChIKey of 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is RCCXHHQDCCDZKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O/c1-2-5-12(6-3-1)9-16-19-14-10-13(11-18-17(14)20-16)15-7-4-8-21-15/h1-8,10-11H,9H2,(H,18,19,20).
What are the key properties of 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine?
2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 275.31 g/mol, XLogP of 3.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-6-(furan-2-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 23025562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).