2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide

C19H22N2O5 — CID 7703795

IUPAC2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CO/N=C\c1cccc(OC)c1OC
InChIInChI=1S/C19H22N2O5/c1-4-25-16-10-6-5-9-15(16)21-18(22)13-26-20-12-14-8-7-11-17(23-2)19(14)24-3/h5-12H,4,13H2,1-3H3,(H,21,22)/b20-12-
InChIKeyUGAGXBMQGVLWAO-NDENLUEZSA-N
MW358.39 g/mol
LogP3.09
Rot. Bonds9

About 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide

2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide (PubChem CID 7703795) has the molecular formula C19H22N2O5 and a molecular weight of 358.39 g/mol. Its IUPAC name is 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide
PubChem CID7703795
Molecular FormulaC19H22N2O5
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CO/N=C\c1cccc(OC)c1OC
InChIInChI=1S/C19H22N2O5/c1-4-25-16-10-6-5-9-15(16)21-18(22)13-26-20-12-14-8-7-11-17(23-2)19(14)24-3/h5-12H,4,13H2,1-3H3,(H,21,22)/b20-12-
InChIKeyUGAGXBMQGVLWAO-NDENLUEZSA-N
XLogP3.09
TPSA78.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 53.09
H-Bond Donors ≤ 51
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 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide (CID 7703795) is 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CO/N=C\c1cccc(OC)c1OC.
What is the InChIKey of 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide?
The InChIKey is UGAGXBMQGVLWAO-NDENLUEZSA-N. The full InChI is InChI=1S/C19H22N2O5/c1-4-25-16-10-6-5-9-15(16)21-18(22)13-26-20-12-14-8-7-11-17(23-2)19(14)24-3/h5-12H,4,13H2,1-3H3,(H,21,22)/b20-12-.
What are the key properties of 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide?
2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide has a molecular weight of 358.39 g/mol, XLogP of 3.09, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(2,3-dimethoxyphenyl)methylideneamino]oxy-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 7703795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).