2-chloropyrido[3,2-f]quinoxaline

C11H6ClN3 — CID 129033345

IUPAC2-chloropyrido[3,2-f]quinoxaline
SMILESClc1cnc2ccc3ncccc3c2n1
InChIInChI=1S/C11H6ClN3/c12-10-6-14-9-4-3-8-7(11(9)15-10)2-1-5-13-8/h1-6H
InChIKeyZEUOZOHRJNSXDG-UHFFFAOYSA-N
MW215.64 g/mol
LogP2.83
Rot. Bonds

About 2-chloropyrido[3,2-f]quinoxaline

2-chloropyrido[3,2-f]quinoxaline (PubChem CID 129033345) has the molecular formula C11H6ClN3 and a molecular weight of 215.64 g/mol. Its IUPAC name is 2-chloropyrido[3,2-f]quinoxaline.

Molecular Properties

Compound Name2-chloropyrido[3,2-f]quinoxaline
PubChem CID129033345
Molecular FormulaC11H6ClN3
Molecular Weight215.64 g/mol
Exact Mass215.03
IUPAC Name2-chloropyrido[3,2-f]quinoxaline
SMILESClc1cnc2ccc3ncccc3c2n1
InChIInChI=1S/C11H6ClN3/c12-10-6-14-9-4-3-8-7(11(9)15-10)2-1-5-13-8/h1-6H
InChIKeyZEUOZOHRJNSXDG-UHFFFAOYSA-N
XLogP2.83
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.64
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloropyrido[3,2-f]quinoxaline?
The IUPAC name of 2-chloropyrido[3,2-f]quinoxaline (CID 129033345) is 2-chloropyrido[3,2-f]quinoxaline.
What is the SMILES notation for 2-chloropyrido[3,2-f]quinoxaline?
The canonical SMILES for 2-chloropyrido[3,2-f]quinoxaline is Clc1cnc2ccc3ncccc3c2n1.
What is the InChIKey of 2-chloropyrido[3,2-f]quinoxaline?
The InChIKey is ZEUOZOHRJNSXDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClN3/c12-10-6-14-9-4-3-8-7(11(9)15-10)2-1-5-13-8/h1-6H.
What are the key properties of 2-chloropyrido[3,2-f]quinoxaline?
2-chloropyrido[3,2-f]quinoxaline has a molecular weight of 215.64 g/mol, XLogP of 2.83, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloropyrido[3,2-f]quinoxaline is sourced from PubChem (CID 129033345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).