2,6-dichloro-3-pyridin-2-ylquinoxaline

C13H7Cl2N3 — CID 556140

IUPAC2,6-dichloro-3-pyridin-2-ylquinoxaline
SMILESClc1ccc2nc(Cl)c(-c3ccccn3)nc2c1
InChIInChI=1S/C13H7Cl2N3/c14-8-4-5-9-11(7-8)17-12(13(15)18-9)10-3-1-2-6-16-10/h1-7H
InChIKeyZNJGREOBTLXZFY-UHFFFAOYSA-N
MW276.13 g/mol
LogP4.00
Rot. Bonds1

About 2,6-dichloro-3-pyridin-2-ylquinoxaline

2,6-dichloro-3-pyridin-2-ylquinoxaline (PubChem CID 556140) has the molecular formula C13H7Cl2N3 and a molecular weight of 276.13 g/mol. Its IUPAC name is 2,6-dichloro-3-pyridin-2-ylquinoxaline.

Molecular Properties

Compound Name2,6-dichloro-3-pyridin-2-ylquinoxaline
PubChem CID556140
Molecular FormulaC13H7Cl2N3
Molecular Weight276.13 g/mol
Exact Mass275.00
IUPAC Name2,6-dichloro-3-pyridin-2-ylquinoxaline
SMILESClc1ccc2nc(Cl)c(-c3ccccn3)nc2c1
InChIInChI=1S/C13H7Cl2N3/c14-8-4-5-9-11(7-8)17-12(13(15)18-9)10-3-1-2-6-16-10/h1-7H
InChIKeyZNJGREOBTLXZFY-UHFFFAOYSA-N
XLogP4.00
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.13
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-3-pyridin-2-ylquinoxaline?
The IUPAC name of 2,6-dichloro-3-pyridin-2-ylquinoxaline (CID 556140) is 2,6-dichloro-3-pyridin-2-ylquinoxaline.
What is the SMILES notation for 2,6-dichloro-3-pyridin-2-ylquinoxaline?
The canonical SMILES for 2,6-dichloro-3-pyridin-2-ylquinoxaline is Clc1ccc2nc(Cl)c(-c3ccccn3)nc2c1.
What is the InChIKey of 2,6-dichloro-3-pyridin-2-ylquinoxaline?
The InChIKey is ZNJGREOBTLXZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl2N3/c14-8-4-5-9-11(7-8)17-12(13(15)18-9)10-3-1-2-6-16-10/h1-7H.
What are the key properties of 2,6-dichloro-3-pyridin-2-ylquinoxaline?
2,6-dichloro-3-pyridin-2-ylquinoxaline has a molecular weight of 276.13 g/mol, XLogP of 4.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-3-pyridin-2-ylquinoxaline is sourced from PubChem (CID 556140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).