N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide

C18H20N2O4 — CID 831096

IUPACN-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
SMILESCOc1ccc(C=NNC(=O)COc2ccccc2C)c(OC)c1
InChIInChI=1S/C18H20N2O4/c1-13-6-4-5-7-16(13)24-12-18(21)20-19-11-14-8-9-15(22-2)10-17(14)23-3/h4-11H,12H2,1-3H3,(H,20,21)
InChIKeyDOVXDVCJLSKQKR-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.54
Rot. Bonds7

About N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide

N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide (PubChem CID 831096) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
PubChem CID831096
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
SMILESCOc1ccc(C=NNC(=O)COc2ccccc2C)c(OC)c1
InChIInChI=1S/C18H20N2O4/c1-13-6-4-5-7-16(13)24-12-18(21)20-19-11-14-8-9-15(22-2)10-17(14)23-3/h4-11H,12H2,1-3H3,(H,20,21)
InChIKeyDOVXDVCJLSKQKR-UHFFFAOYSA-N
XLogP2.54
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.54
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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Related Compounds

N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-(2,3-dimethylphenoxy)acetamide
CID 5426190
2-(2-chlorophenoxy)-N-[(2,4-dimethoxyphenyl)methylideneamino]acetamide
CID 958496
2-(2-methylphenoxy)-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide
CID 5456697
2-(2-benzylphenoxy)-N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]acetamide
CID 9359690
2-(4-tert-butyl-2-methylphenoxy)-N-[(2,4-dimethoxyphenyl)methylideneamino]acetamide
CID 1105085
N-[(E)-(4-methoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide
CID 6870806
2-(2,4-dimethylphenoxy)-N-[(E)-(2-methoxyphenyl)methylideneamino]acetamide
CID 6891509
N-[(Z)-(2,4-dimethylphenyl)methylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 5414113
2-(2,6-dimethylphenoxy)-N-[(Z)-(2-methoxyphenyl)methylideneamino]acetamide
CID 5420735
N-[(Z)-(2,4-dimethoxyphenyl)methylideneamino]-2-methylbenzamide
CID 6042268
[4-[[[2-(2-methylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 3,4,5-trimethoxybenzoate
CID 1270713
2-(4-chloro-2-methylphenoxy)-N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]acetamide
CID 6165893

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide (CID 831096) is N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide is COc1ccc(C=NNC(=O)COc2ccccc2C)c(OC)c1.
What is the InChIKey of N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide?
The InChIKey is DOVXDVCJLSKQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-13-6-4-5-7-16(13)24-12-18(21)20-19-11-14-8-9-15(22-2)10-17(14)23-3/h4-11H,12H2,1-3H3,(H,20,21).
What are the key properties of N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide?
N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide has a molecular weight of 328.37 g/mol, XLogP of 2.54, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethoxyphenyl)methylideneamino]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 831096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).