2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide

C24H24N2O4 — CID 9315812

IUPAC2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide
SMILESCOc1ccccc1OCC(=O)N/N=C(/C)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H24N2O4/c1-18(25-26-24(27)17-30-23-11-7-6-10-22(23)28-2)20-12-14-21(15-13-20)29-16-19-8-4-3-5-9-19/h3-15H,16-17H2,1-2H3,(H,26,27)/b25-18-
InChIKeyWRLLITLZRMPNDE-BWAHOGKJSA-N
MW404.47 g/mol
LogP4.19
Rot. Bonds9

About 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide

2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide (PubChem CID 9315812) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide
PubChem CID9315812
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide
SMILESCOc1ccccc1OCC(=O)N/N=C(/C)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C24H24N2O4/c1-18(25-26-24(27)17-30-23-11-7-6-10-22(23)28-2)20-12-14-21(15-13-20)29-16-19-8-4-3-5-9-19/h3-15H,16-17H2,1-2H3,(H,26,27)/b25-18-
InChIKeyWRLLITLZRMPNDE-BWAHOGKJSA-N
XLogP4.19
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.19
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 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide (CID 9315812) is 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide is COc1ccccc1OCC(=O)N/N=C(/C)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide?
The InChIKey is WRLLITLZRMPNDE-BWAHOGKJSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-18(25-26-24(27)17-30-23-11-7-6-10-22(23)28-2)20-12-14-21(15-13-20)29-16-19-8-4-3-5-9-19/h3-15H,16-17H2,1-2H3,(H,26,27)/b25-18-.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide?
2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide has a molecular weight of 404.47 g/mol, XLogP of 4.19, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(Z)-1-(4-phenylmethoxyphenyl)ethylideneamino]acetamide is sourced from PubChem (CID 9315812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).