3-(4-chloro-2-fluorophenyl)-6-methylpyridazine

C11H8ClFN2 — CID 67474860

IUPAC3-(4-chloro-2-fluorophenyl)-6-methylpyridazine
SMILESCc1ccc(-c2ccc(Cl)cc2F)nn1
InChIInChI=1S/C11H8ClFN2/c1-7-2-5-11(15-14-7)9-4-3-8(12)6-10(9)13/h2-6H,1H3
InChIKeyINRLRBJKOMVVNN-UHFFFAOYSA-N
MW222.65 g/mol
LogP3.24
Rot. Bonds1

About 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine

3-(4-chloro-2-fluorophenyl)-6-methylpyridazine (PubChem CID 67474860) has the molecular formula C11H8ClFN2 and a molecular weight of 222.65 g/mol. Its IUPAC name is 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine.

Molecular Properties

Compound Name3-(4-chloro-2-fluorophenyl)-6-methylpyridazine
PubChem CID67474860
Molecular FormulaC11H8ClFN2
Molecular Weight222.65 g/mol
Exact Mass222.04
IUPAC Name3-(4-chloro-2-fluorophenyl)-6-methylpyridazine
SMILESCc1ccc(-c2ccc(Cl)cc2F)nn1
InChIInChI=1S/C11H8ClFN2/c1-7-2-5-11(15-14-7)9-4-3-8(12)6-10(9)13/h2-6H,1H3
InChIKeyINRLRBJKOMVVNN-UHFFFAOYSA-N
XLogP3.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.65
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine 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-(4-chloro-2-fluorophenyl)-6-methylpyridazine?
The IUPAC name of 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine (CID 67474860) is 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine.
What is the SMILES notation for 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine?
The canonical SMILES for 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine is Cc1ccc(-c2ccc(Cl)cc2F)nn1.
What is the InChIKey of 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine?
The InChIKey is INRLRBJKOMVVNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2/c1-7-2-5-11(15-14-7)9-4-3-8(12)6-10(9)13/h2-6H,1H3.
What are the key properties of 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine?
3-(4-chloro-2-fluorophenyl)-6-methylpyridazine has a molecular weight of 222.65 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-2-fluorophenyl)-6-methylpyridazine is sourced from PubChem (CID 67474860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).