(E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine

C20H24N2O4 — CID 5337897

IUPAC(E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine
SMILESCOc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C20H24N2O4/c1-13(17-9-7-15(23-3)11-19(17)25-5)21-22-14(2)18-10-8-16(24-4)12-20(18)26-6/h7-12H,1-6H3/b21-13+,22-14+
InChIKeyALPRNNHLTNJSAQ-JFMUQQRKSA-N
MW356.42 g/mol
LogP3.95
Rot. Bonds7

About (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine

(E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine (PubChem CID 5337897) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine.

Molecular Properties

Compound Name(E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine
PubChem CID5337897
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name(E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine
SMILESCOc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C20H24N2O4/c1-13(17-9-7-15(23-3)11-19(17)25-5)21-22-14(2)18-10-8-16(24-4)12-20(18)26-6/h7-12H,1-6H3/b21-13+,22-14+
InChIKeyALPRNNHLTNJSAQ-JFMUQQRKSA-N
XLogP3.95
TPSA61.64 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine?
The IUPAC name of (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine (CID 5337897) is (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine.
What is the SMILES notation for (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine?
The canonical SMILES for (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine is COc1ccc(/C(C)=N/N=C(\C)c2ccc(OC)cc2OC)c(OC)c1.
What is the InChIKey of (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine?
The InChIKey is ALPRNNHLTNJSAQ-JFMUQQRKSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-13(17-9-7-15(23-3)11-19(17)25-5)21-22-14(2)18-10-8-16(24-4)12-20(18)26-6/h7-12H,1-6H3/b21-13+,22-14+.
What are the key properties of (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine?
(E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine has a molecular weight of 356.42 g/mol, XLogP of 3.95, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(2,4-dimethoxyphenyl)-N-[(E)-1-(2,4-dimethoxyphenyl)ethylideneamino]ethanimine is sourced from PubChem (CID 5337897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).