3-chloro-4-ethyl-5-methylpyridazine

C7H9ClN2 — CID 174572553

IUPAC3-chloro-4-ethyl-5-methylpyridazine
SMILESCCc1c(C)cnnc1Cl
InChIInChI=1S/C7H9ClN2/c1-3-6-5(2)4-9-10-7(6)8/h4H,3H2,1-2H3
InChIKeyZVTITUGOIBAHCI-UHFFFAOYSA-N
MW156.62 g/mol
LogP2.00
Rot. Bonds1

About 3-chloro-4-ethyl-5-methylpyridazine

3-chloro-4-ethyl-5-methylpyridazine (PubChem CID 174572553) has the molecular formula C7H9ClN2 and a molecular weight of 156.62 g/mol. Its IUPAC name is 3-chloro-4-ethyl-5-methylpyridazine.

Molecular Properties

Compound Name3-chloro-4-ethyl-5-methylpyridazine
PubChem CID174572553
Molecular FormulaC7H9ClN2
Molecular Weight156.62 g/mol
Exact Mass156.05
IUPAC Name3-chloro-4-ethyl-5-methylpyridazine
SMILESCCc1c(C)cnnc1Cl
InChIInChI=1S/C7H9ClN2/c1-3-6-5(2)4-9-10-7(6)8/h4H,3H2,1-2H3
InChIKeyZVTITUGOIBAHCI-UHFFFAOYSA-N
XLogP2.00
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.62
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-chloro-4-ethyl-5-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-chloro-4-ethyl-5-methylpyridazine?
The IUPAC name of 3-chloro-4-ethyl-5-methylpyridazine (CID 174572553) is 3-chloro-4-ethyl-5-methylpyridazine.
What is the SMILES notation for 3-chloro-4-ethyl-5-methylpyridazine?
The canonical SMILES for 3-chloro-4-ethyl-5-methylpyridazine is CCc1c(C)cnnc1Cl.
What is the InChIKey of 3-chloro-4-ethyl-5-methylpyridazine?
The InChIKey is ZVTITUGOIBAHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2/c1-3-6-5(2)4-9-10-7(6)8/h4H,3H2,1-2H3.
What are the key properties of 3-chloro-4-ethyl-5-methylpyridazine?
3-chloro-4-ethyl-5-methylpyridazine has a molecular weight of 156.62 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-ethyl-5-methylpyridazine is sourced from PubChem (CID 174572553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).