7-chloro-2-(1H-pyrazol-5-yl)quinoxaline

C11H7ClN4 — CID 29023998

IUPAC7-chloro-2-(1H-pyrazol-5-yl)quinoxaline
SMILESClc1ccc2ncc(-c3ccn[nH]3)nc2c1
InChIInChI=1S/C11H7ClN4/c12-7-1-2-8-10(5-7)15-11(6-13-8)9-3-4-14-16-9/h1-6H,(H,14,16)
InChIKeyALLFISONUKAVQG-UHFFFAOYSA-N
MW230.66 g/mol
LogP2.67
Rot. Bonds1

About 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline

7-chloro-2-(1H-pyrazol-5-yl)quinoxaline (PubChem CID 29023998) has the molecular formula C11H7ClN4 and a molecular weight of 230.66 g/mol. Its IUPAC name is 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline.

Molecular Properties

Compound Name7-chloro-2-(1H-pyrazol-5-yl)quinoxaline
PubChem CID29023998
Molecular FormulaC11H7ClN4
Molecular Weight230.66 g/mol
Exact Mass230.04
IUPAC Name7-chloro-2-(1H-pyrazol-5-yl)quinoxaline
SMILESClc1ccc2ncc(-c3ccn[nH]3)nc2c1
InChIInChI=1S/C11H7ClN4/c12-7-1-2-8-10(5-7)15-11(6-13-8)9-3-4-14-16-9/h1-6H,(H,14,16)
InChIKeyALLFISONUKAVQG-UHFFFAOYSA-N
XLogP2.67
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.66
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline?
The IUPAC name of 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline (CID 29023998) is 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline.
What is the SMILES notation for 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline?
The canonical SMILES for 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline is Clc1ccc2ncc(-c3ccn[nH]3)nc2c1.
What is the InChIKey of 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline?
The InChIKey is ALLFISONUKAVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClN4/c12-7-1-2-8-10(5-7)15-11(6-13-8)9-3-4-14-16-9/h1-6H,(H,14,16).
What are the key properties of 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline?
7-chloro-2-(1H-pyrazol-5-yl)quinoxaline has a molecular weight of 230.66 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(1H-pyrazol-5-yl)quinoxaline is sourced from PubChem (CID 29023998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).