4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine

C15H18N2O — CID 126536054

IUPAC4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine
SMILESC=C1C(C)=C(OCC)C=NN1c1cccc(C)c1
InChIInChI=1S/C15H18N2O/c1-5-18-15-10-16-17(13(4)12(15)3)14-8-6-7-11(2)9-14/h6-10H,4-5H2,1-3H3
InChIKeyCYQPDBRGWHOSBE-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.63
Rot. Bonds3

About 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine

4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine (PubChem CID 126536054) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine.

Molecular Properties

Compound Name4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine
PubChem CID126536054
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine
SMILESC=C1C(C)=C(OCC)C=NN1c1cccc(C)c1
InChIInChI=1S/C15H18N2O/c1-5-18-15-10-16-17(13(4)12(15)3)14-8-6-7-11(2)9-14/h6-10H,4-5H2,1-3H3
InChIKeyCYQPDBRGWHOSBE-UHFFFAOYSA-N
XLogP3.63
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(4-ethoxyphenyl)-3-[4-(3-methylphenyl)piperazin-1-yl]propanamide
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ethyl 5-amino-1-(3-methylphenyl)pyrazole-3-carboxylate
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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine?
The IUPAC name of 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine (CID 126536054) is 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine.
What is the SMILES notation for 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine?
The canonical SMILES for 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine is C=C1C(C)=C(OCC)C=NN1c1cccc(C)c1.
What is the InChIKey of 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine?
The InChIKey is CYQPDBRGWHOSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-5-18-15-10-16-17(13(4)12(15)3)14-8-6-7-11(2)9-14/h6-10H,4-5H2,1-3H3.
What are the key properties of 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine?
4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine has a molecular weight of 242.32 g/mol, XLogP of 3.63, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-5-methyl-6-methylidene-1-(3-methylphenyl)pyridazine is sourced from PubChem (CID 126536054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).