3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline

C20H14N4O — CID 662056

IUPAC3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline
SMILESc1ccc(Cn2c(-c3ccco3)nc3nc4ccccc4nc32)cc1
InChIInChI=1S/C20H14N4O/c1-2-7-14(8-3-1)13-24-19(17-11-6-12-25-17)23-18-20(24)22-16-10-5-4-9-15(16)21-18/h1-12H,13H2
InChIKeyURIHKRCZXXJGGB-UHFFFAOYSA-N
MW326.36 g/mol
LogP4.29
Rot. Bonds3

About 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline

3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline (PubChem CID 662056) has the molecular formula C20H14N4O and a molecular weight of 326.36 g/mol. Its IUPAC name is 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline.

Molecular Properties

Compound Name3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline
PubChem CID662056
Molecular FormulaC20H14N4O
Molecular Weight326.36 g/mol
Exact Mass326.12
IUPAC Name3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline
SMILESc1ccc(Cn2c(-c3ccco3)nc3nc4ccccc4nc32)cc1
InChIInChI=1S/C20H14N4O/c1-2-7-14(8-3-1)13-24-19(17-11-6-12-25-17)23-18-20(24)22-16-10-5-4-9-15(16)21-18/h1-12H,13H2
InChIKeyURIHKRCZXXJGGB-UHFFFAOYSA-N
XLogP4.29
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline?
The IUPAC name of 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline (CID 662056) is 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline.
What is the SMILES notation for 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline?
The canonical SMILES for 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline is c1ccc(Cn2c(-c3ccco3)nc3nc4ccccc4nc32)cc1.
What is the InChIKey of 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline?
The InChIKey is URIHKRCZXXJGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O/c1-2-7-14(8-3-1)13-24-19(17-11-6-12-25-17)23-18-20(24)22-16-10-5-4-9-15(16)21-18/h1-12H,13H2.
What are the key properties of 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline?
3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline has a molecular weight of 326.36 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-2-(furan-2-yl)imidazo[4,5-b]quinoxaline is sourced from PubChem (CID 662056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).