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

C19H22N2O4 — CID 5426190

IUPACN-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide
SMILESCOc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)c(OC)c1
InChIInChI=1S/C19H22N2O4/c1-13-6-5-7-17(14(13)2)25-12-19(22)21-20-11-15-8-9-16(23-3)10-18(15)24-4/h5-11H,12H2,1-4H3,(H,21,22)/b20-11-
InChIKeyVYEYJMPJONXZQJ-JAIQZWGSSA-N
MW342.40 g/mol
LogP2.85
Rot. Bonds7

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

N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide (PubChem CID 5426190) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide
PubChem CID5426190
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide
SMILESCOc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)c(OC)c1
InChIInChI=1S/C19H22N2O4/c1-13-6-5-7-17(14(13)2)25-12-19(22)21-20-11-15-8-9-16(23-3)10-18(15)24-4/h5-11H,12H2,1-4H3,(H,21,22)/b20-11-
InChIKeyVYEYJMPJONXZQJ-JAIQZWGSSA-N
XLogP2.85
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.85
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)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide?
The IUPAC name of N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide (CID 5426190) is N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide?
The canonical SMILES for N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide is COc1ccc(/C=N\NC(=O)COc2cccc(C)c2C)c(OC)c1.
What is the InChIKey of N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide?
The InChIKey is VYEYJMPJONXZQJ-JAIQZWGSSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13-6-5-7-17(14(13)2)25-12-19(22)21-20-11-15-8-9-16(23-3)10-18(15)24-4/h5-11H,12H2,1-4H3,(H,21,22)/b20-11-.
What are the key properties of N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide?
N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide has a molecular weight of 342.40 g/mol, XLogP of 2.85, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide is sourced from PubChem (CID 5426190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).