2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide

C23H23N3O3 — CID 4005340

IUPAC2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide
SMILESCOc1ccc(NCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1
InChIInChI=1S/C23H23N3O3/c1-28-21-13-11-20(12-14-21)24-16-23(27)26-25-15-19-9-5-6-10-22(19)29-17-18-7-3-2-4-8-18/h2-15,24H,16-17H2,1H3,(H,26,27)
InChIKeyXREBLZUWFFHMJL-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.84
Rot. Bonds9

About 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide

2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide (PubChem CID 4005340) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide
PubChem CID4005340
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide
SMILESCOc1ccc(NCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1
InChIInChI=1S/C23H23N3O3/c1-28-21-13-11-20(12-14-21)24-16-23(27)26-25-15-19-9-5-6-10-22(19)29-17-18-7-3-2-4-8-18/h2-15,24H,16-17H2,1H3,(H,26,27)
InChIKeyXREBLZUWFFHMJL-UHFFFAOYSA-N
XLogP3.84
TPSA71.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-ethoxyanilino)-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide
CID 6118655
4-methoxy-N-[2-oxo-2-[(2E)-2-[(2-phenylmethoxyphenyl)methylidene]hydrazinyl]ethyl]benzamide
CID 51061317
4-methoxy-N-[3-oxo-3-[2-[(2-phenylmethoxyphenyl)methylidene]hydrazinyl]propyl]benzamide
CID 4221647
N'-[[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(4-methoxyphenyl)propanediamide
CID 3903944
N-(4-methoxyphenyl)-N'-[(2-phenylmethoxyphenyl)methylideneamino]-2-propan-2-ylpropanediamide
CID 4987126
N,N'-bis[(Z)-(2-phenylmethoxyphenyl)methylideneamino]heptanediamide
CID 6089663
2-[benzyl-(4-methoxyphenyl)sulfonylamino]-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide
CID 6033568
N-(4-ethoxyphenyl)-N'-[(2-phenylmethoxyphenyl)methylideneamino]propanediamide
CID 4561777
2,4-dimethoxy-N-[(2-phenylmethoxyphenyl)methylideneamino]benzamide
CID 4562741
2-naphthalen-2-yloxy-N-[(Z)-(2-phenylmethoxyphenyl)methylideneamino]acetamide
CID 6041934
2-(4-methoxyanilino)-N-[(4-methoxynaphthalen-1-yl)methylideneamino]acetamide
CID 4628921
2-(4-ethoxyanilino)-N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 136721150

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide (CID 4005340) is 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide is COc1ccc(NCC(=O)NN=Cc2ccccc2OCc2ccccc2)cc1.
What is the InChIKey of 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide?
The InChIKey is XREBLZUWFFHMJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-28-21-13-11-20(12-14-21)24-16-23(27)26-25-15-19-9-5-6-10-22(19)29-17-18-7-3-2-4-8-18/h2-15,24H,16-17H2,1H3,(H,26,27).
What are the key properties of 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide?
2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide has a molecular weight of 389.46 g/mol, XLogP of 3.84, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyanilino)-N-[(2-phenylmethoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 4005340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).