(E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine

C20H24N2 — CID 177451441

IUPAC(E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine
SMILESC/C(=N\N=C(/C)c1ccc(C)c(C)c1)c1ccc(C)c(C)c1
InChIInChI=1S/C20H24N2/c1-13-7-9-19(11-15(13)3)17(5)21-22-18(6)20-10-8-14(2)16(4)12-20/h7-12H,1-6H3/b21-17+,22-18+
InChIKeyFPQWHQZHBCFNNL-KSTNYAOJSA-N
MW292.43 g/mol
LogP5.15
Rot. Bonds3

About (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine

(E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine (PubChem CID 177451441) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine.

Molecular Properties

Compound Name(E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine
PubChem CID177451441
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name(E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine
SMILESC/C(=N\N=C(/C)c1ccc(C)c(C)c1)c1ccc(C)c(C)c1
InChIInChI=1S/C20H24N2/c1-13-7-9-19(11-15(13)3)17(5)21-22-18(6)20-10-8-14(2)16(4)12-20/h7-12H,1-6H3/b21-17+,22-18+
InChIKeyFPQWHQZHBCFNNL-KSTNYAOJSA-N
XLogP5.15
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.43
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine?
The IUPAC name of (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine (CID 177451441) is (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine.
What is the SMILES notation for (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine?
The canonical SMILES for (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine is C/C(=N\N=C(/C)c1ccc(C)c(C)c1)c1ccc(C)c(C)c1.
What is the InChIKey of (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine?
The InChIKey is FPQWHQZHBCFNNL-KSTNYAOJSA-N. The full InChI is InChI=1S/C20H24N2/c1-13-7-9-19(11-15(13)3)17(5)21-22-18(6)20-10-8-14(2)16(4)12-20/h7-12H,1-6H3/b21-17+,22-18+.
What are the key properties of (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine?
(E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine has a molecular weight of 292.43 g/mol, XLogP of 5.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(3,4-dimethylphenyl)-N-[(E)-1-(3,4-dimethylphenyl)ethylideneamino]ethanimine is sourced from PubChem (CID 177451441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).