3-chloro-6-ethylpyridazine

C6H7ClN2 — CID 20539495

IUPAC3-chloro-6-ethylpyridazine
SMILESCCc1ccc(Cl)nn1
InChIInChI=1S/C6H7ClN2/c1-2-5-3-4-6(7)9-8-5/h3-4H,2H2,1H3
InChIKeyLAOHYGKZUOWKBO-UHFFFAOYSA-N
MW142.59 g/mol
LogP1.69
Rot. Bonds1

About 3-chloro-6-ethylpyridazine

3-chloro-6-ethylpyridazine (PubChem CID 20539495) has the molecular formula C6H7ClN2 and a molecular weight of 142.59 g/mol. Its IUPAC name is 3-chloro-6-ethylpyridazine.

Molecular Properties

Compound Name3-chloro-6-ethylpyridazine
PubChem CID20539495
Molecular FormulaC6H7ClN2
Molecular Weight142.59 g/mol
Exact Mass142.03
IUPAC Name3-chloro-6-ethylpyridazine
SMILESCCc1ccc(Cl)nn1
InChIInChI=1S/C6H7ClN2/c1-2-5-3-4-6(7)9-8-5/h3-4H,2H2,1H3
InChIKeyLAOHYGKZUOWKBO-UHFFFAOYSA-N
XLogP1.69
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.59
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-chloro-6-ethylpyridazine 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 3-chloro-6-ethylpyridazine?
The IUPAC name of 3-chloro-6-ethylpyridazine (CID 20539495) is 3-chloro-6-ethylpyridazine.
What is the SMILES notation for 3-chloro-6-ethylpyridazine?
The canonical SMILES for 3-chloro-6-ethylpyridazine is CCc1ccc(Cl)nn1.
What is the InChIKey of 3-chloro-6-ethylpyridazine?
The InChIKey is LAOHYGKZUOWKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2/c1-2-5-3-4-6(7)9-8-5/h3-4H,2H2,1H3.
What are the key properties of 3-chloro-6-ethylpyridazine?
3-chloro-6-ethylpyridazine has a molecular weight of 142.59 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-ethylpyridazine is sourced from PubChem (CID 20539495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).