4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine

C13H12N2O — CID 5376016

IUPAC4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine
SMILESCOc1ccc(/C=C/c2ccnnc2)cc1
InChIInChI=1S/C13H12N2O/c1-16-13-6-4-11(5-7-13)2-3-12-8-9-14-15-10-12/h2-10H,1H3/b3-2+
InChIKeyZIJXOQWZRRMVOY-NSCUHMNNSA-N
MW212.25 g/mol
LogP2.66
Rot. Bonds3

About 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine

4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine (PubChem CID 5376016) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine.

Molecular Properties

Compound Name4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine
PubChem CID5376016
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine
SMILESCOc1ccc(/C=C/c2ccnnc2)cc1
InChIInChI=1S/C13H12N2O/c1-16-13-6-4-11(5-7-13)2-3-12-8-9-14-15-10-12/h2-10H,1H3/b3-2+
InChIKeyZIJXOQWZRRMVOY-NSCUHMNNSA-N
XLogP2.66
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methoxyphthalazine
CID 154882
Credazine
CID 26715
3,6-Bis(4-methylphenoxy)pyridazine
CID 6408790
3-(6-Ethoxy-pyridazin-4-yl)-benzonitrile
CID 11629964
5-(3-Bromo-phenyl)-3-methoxy-pyridazine
CID 11694609
4-Pyridazin-3-yloxybenzonitrile
CID 57402654
3-Phenoxypyridazine
CID 599070
5-Bromo-3-(2-methoxyphenyl)pyridazine
CID 117107079
N-(4-methoxyphenyl)-1-pyridazin-4-ylmethanimine
CID 11127609
3-Chloro-5-(4-methoxyphenyl)pyridazine
CID 13558917
3-Methoxy-6-(4-methoxyphenyl)pyridazine
CID 15445189
6-Methoxyphthalazine
CID 22114751

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine?
The IUPAC name of 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine (CID 5376016) is 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine.
What is the SMILES notation for 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine?
The canonical SMILES for 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine is COc1ccc(/C=C/c2ccnnc2)cc1.
What is the InChIKey of 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine?
The InChIKey is ZIJXOQWZRRMVOY-NSCUHMNNSA-N. The full InChI is InChI=1S/C13H12N2O/c1-16-13-6-4-11(5-7-13)2-3-12-8-9-14-15-10-12/h2-10H,1H3/b3-2+.
What are the key properties of 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine?
4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine has a molecular weight of 212.25 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridazine is sourced from PubChem (CID 5376016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).