2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline

C15H9ClN4 — CID 11652061

IUPAC2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline
SMILESClc1ccc2nc(-c3cnc4ccccc4n3)[nH]c2c1
InChIInChI=1S/C15H9ClN4/c16-9-5-6-12-13(7-9)20-15(19-12)14-8-17-10-3-1-2-4-11(10)18-14/h1-8H,(H,19,20)
InChIKeySOUPHJBGFDZRAD-UHFFFAOYSA-N
MW280.72 g/mol
LogP3.83
Rot. Bonds1

About 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline

2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline (PubChem CID 11652061) has the molecular formula C15H9ClN4 and a molecular weight of 280.72 g/mol. Its IUPAC name is 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline.

Molecular Properties

Compound Name2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline
PubChem CID11652061
Molecular FormulaC15H9ClN4
Molecular Weight280.72 g/mol
Exact Mass280.05
IUPAC Name2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline
SMILESClc1ccc2nc(-c3cnc4ccccc4n3)[nH]c2c1
InChIInChI=1S/C15H9ClN4/c16-9-5-6-12-13(7-9)20-15(19-12)14-8-17-10-3-1-2-4-11(10)18-14/h1-8H,(H,19,20)
InChIKeySOUPHJBGFDZRAD-UHFFFAOYSA-N
XLogP3.83
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.72
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline?
The IUPAC name of 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline (CID 11652061) is 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline.
What is the SMILES notation for 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline?
The canonical SMILES for 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline is Clc1ccc2nc(-c3cnc4ccccc4n3)[nH]c2c1.
What is the InChIKey of 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline?
The InChIKey is SOUPHJBGFDZRAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClN4/c16-9-5-6-12-13(7-9)20-15(19-12)14-8-17-10-3-1-2-4-11(10)18-14/h1-8H,(H,19,20).
What are the key properties of 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline?
2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline has a molecular weight of 280.72 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-1H-benzimidazol-2-yl)quinoxaline is sourced from PubChem (CID 11652061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).