N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide

C20H24N2O4 — CID 9316157

IUPACN-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide
SMILESCOc1ccc(/C(C)=N\NC(=O)COc2ccc(C)c(C)c2)c(OC)c1
InChIInChI=1S/C20H24N2O4/c1-13-6-7-17(10-14(13)2)26-12-20(23)22-21-15(3)18-9-8-16(24-4)11-19(18)25-5/h6-11H,12H2,1-5H3,(H,22,23)/b21-15-
InChIKeyFKDBERZQLJVTDX-QNGOZBTKSA-N
MW356.42 g/mol
LogP3.24
Rot. Bonds7

About N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide

N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide (PubChem CID 9316157) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide
PubChem CID9316157
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide
SMILESCOc1ccc(/C(C)=N\NC(=O)COc2ccc(C)c(C)c2)c(OC)c1
InChIInChI=1S/C20H24N2O4/c1-13-6-7-17(10-14(13)2)26-12-20(23)22-21-15(3)18-9-8-16(24-4)11-19(18)25-5/h6-11H,12H2,1-5H3,(H,22,23)/b21-15-
InChIKeyFKDBERZQLJVTDX-QNGOZBTKSA-N
XLogP3.24
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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 N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide?
The IUPAC name of N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide (CID 9316157) is N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide?
The canonical SMILES for N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide is COc1ccc(/C(C)=N\NC(=O)COc2ccc(C)c(C)c2)c(OC)c1.
What is the InChIKey of N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide?
The InChIKey is FKDBERZQLJVTDX-QNGOZBTKSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-13-6-7-17(10-14(13)2)26-12-20(23)22-21-15(3)18-9-8-16(24-4)11-19(18)25-5/h6-11H,12H2,1-5H3,(H,22,23)/b21-15-.
What are the key properties of N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide?
N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide has a molecular weight of 356.42 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(2,4-dimethoxyphenyl)ethylideneamino]-2-(3,4-dimethylphenoxy)acetamide is sourced from PubChem (CID 9316157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).