3-(2,4,6-trimethylphenyl)pyridazine

C13H14N2 — CID 67379258

IUPAC3-(2,4,6-trimethylphenyl)pyridazine
SMILESCc1cc(C)c(-c2cccnn2)c(C)c1
InChIInChI=1S/C13H14N2/c1-9-7-10(2)13(11(3)8-9)12-5-4-6-14-15-12/h4-8H,1-3H3
InChIKeyCEOLTUYHSGYDBD-UHFFFAOYSA-N
MW198.27 g/mol
LogP3.07
Rot. Bonds1

About 3-(2,4,6-trimethylphenyl)pyridazine

3-(2,4,6-trimethylphenyl)pyridazine (PubChem CID 67379258) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 3-(2,4,6-trimethylphenyl)pyridazine.

Molecular Properties

Compound Name3-(2,4,6-trimethylphenyl)pyridazine
PubChem CID67379258
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name3-(2,4,6-trimethylphenyl)pyridazine
SMILESCc1cc(C)c(-c2cccnn2)c(C)c1
InChIInChI=1S/C13H14N2/c1-9-7-10(2)13(11(3)8-9)12-5-4-6-14-15-12/h4-8H,1-3H3
InChIKeyCEOLTUYHSGYDBD-UHFFFAOYSA-N
XLogP3.07
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,4,6-trimethylphenyl)pyridazine?
The IUPAC name of 3-(2,4,6-trimethylphenyl)pyridazine (CID 67379258) is 3-(2,4,6-trimethylphenyl)pyridazine.
What is the SMILES notation for 3-(2,4,6-trimethylphenyl)pyridazine?
The canonical SMILES for 3-(2,4,6-trimethylphenyl)pyridazine is Cc1cc(C)c(-c2cccnn2)c(C)c1.
What is the InChIKey of 3-(2,4,6-trimethylphenyl)pyridazine?
The InChIKey is CEOLTUYHSGYDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-9-7-10(2)13(11(3)8-9)12-5-4-6-14-15-12/h4-8H,1-3H3.
What are the key properties of 3-(2,4,6-trimethylphenyl)pyridazine?
3-(2,4,6-trimethylphenyl)pyridazine has a molecular weight of 198.27 g/mol, XLogP of 3.07, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4,6-trimethylphenyl)pyridazine is sourced from PubChem (CID 67379258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).