3-chloro-4-methyl-6-(3-methylphenyl)pyridazine

C12H11ClN2 — CID 14450223

IUPAC3-chloro-4-methyl-6-(3-methylphenyl)pyridazine
SMILESCc1cccc(-c2cc(C)c(Cl)nn2)c1
InChIInChI=1S/C12H11ClN2/c1-8-4-3-5-10(6-8)11-7-9(2)12(13)15-14-11/h3-7H,1-2H3
InChIKeyXURDFJXQYHWSES-UHFFFAOYSA-N
MW218.69 g/mol
LogP3.41
Rot. Bonds1

About 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine

3-chloro-4-methyl-6-(3-methylphenyl)pyridazine (PubChem CID 14450223) has the molecular formula C12H11ClN2 and a molecular weight of 218.69 g/mol. Its IUPAC name is 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine.

Molecular Properties

Compound Name3-chloro-4-methyl-6-(3-methylphenyl)pyridazine
PubChem CID14450223
Molecular FormulaC12H11ClN2
Molecular Weight218.69 g/mol
Exact Mass218.06
IUPAC Name3-chloro-4-methyl-6-(3-methylphenyl)pyridazine
SMILESCc1cccc(-c2cc(C)c(Cl)nn2)c1
InChIInChI=1S/C12H11ClN2/c1-8-4-3-5-10(6-8)11-7-9(2)12(13)15-14-11/h3-7H,1-2H3
InChIKeyXURDFJXQYHWSES-UHFFFAOYSA-N
XLogP3.41
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.69
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-6-(3-methylphenyl)pyridazin-3-amine
CID 117106954
5-chloro-3-(3-methylphenyl)pyridazine
CID 117106953
4,6-dichloro-5-iodo-2-(3-methylphenyl)pyrimidine
CID 66316828
3-(6-chloro-4-methylpyridazin-3-yl)-N,N-dimethylbenzamide;3-(6-chloro-5-methylpyridazin-3-yl)-N,N-dimethylbenzamide
CID 162093498
2-chloro-4-(3-methylphenyl)pyrimidine
CID 24901884
4-chloro-2-(3-methylphenyl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 118037185
3-(2-benzylphenyl)-4-methyl-6-(3-methylphenyl)pyridazine
CID 70949341
4,6-dichloro-5-ethyl-2-(3-methylphenyl)pyrimidine
CID 63612987
4-(3-methylphenyl)thiadiazole
CID 59767702
ethane;3-(3-methylphenyl)-6-(trifluoromethyl)pyridazine
CID 144595447
3,4-dimethyl-6-phenylpyridazine
CID 14040320
1-(3-chloro-4-methylphenyl)-3,5-bis(3-methylphenyl)pyrazole
CID 19587265

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine?
The IUPAC name of 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine (CID 14450223) is 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine.
What is the SMILES notation for 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine?
The canonical SMILES for 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine is Cc1cccc(-c2cc(C)c(Cl)nn2)c1.
What is the InChIKey of 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine?
The InChIKey is XURDFJXQYHWSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2/c1-8-4-3-5-10(6-8)11-7-9(2)12(13)15-14-11/h3-7H,1-2H3.
What are the key properties of 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine?
3-chloro-4-methyl-6-(3-methylphenyl)pyridazine has a molecular weight of 218.69 g/mol, XLogP of 3.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-methyl-6-(3-methylphenyl)pyridazine is sourced from PubChem (CID 14450223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).