5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine

C16H20N2 — CID 20601368

IUPAC5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine
SMILESC=C1C(CC)=C(c2ccc(C)cc2)C(C)=NN1C
InChIInChI=1S/C16H20N2/c1-6-15-13(4)18(5)17-12(3)16(15)14-9-7-11(2)8-10-14/h7-10H,4,6H2,1-3,5H3
InChIKeyALUPKNSCRNBZTG-UHFFFAOYSA-N
MW240.35 g/mol
LogP3.99
Rot. Bonds2

About 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine

5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine (PubChem CID 20601368) has the molecular formula C16H20N2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine.

Molecular Properties

Compound Name5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine
PubChem CID20601368
Molecular FormulaC16H20N2
Molecular Weight240.35 g/mol
Exact Mass240.16
IUPAC Name5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine
SMILESC=C1C(CC)=C(c2ccc(C)cc2)C(C)=NN1C
InChIInChI=1S/C16H20N2/c1-6-15-13(4)18(5)17-12(3)16(15)14-9-7-11(2)8-10-14/h7-10H,4,6H2,1-3,5H3
InChIKeyALUPKNSCRNBZTG-UHFFFAOYSA-N
XLogP3.99
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine?
The IUPAC name of 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine (CID 20601368) is 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine.
What is the SMILES notation for 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine?
The canonical SMILES for 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine is C=C1C(CC)=C(c2ccc(C)cc2)C(C)=NN1C.
What is the InChIKey of 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine?
The InChIKey is ALUPKNSCRNBZTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2/c1-6-15-13(4)18(5)17-12(3)16(15)14-9-7-11(2)8-10-14/h7-10H,4,6H2,1-3,5H3.
What are the key properties of 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine?
5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine has a molecular weight of 240.35 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1,3-dimethyl-6-methylidene-4-(4-methylphenyl)pyridazine is sourced from PubChem (CID 20601368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).