N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide

C17H17N3O4 — CID 6910290

IUPACN'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide
SMILESCOc1ccc(/C=N/NC(=O)C(N)=O)cc1OCc1ccccc1
InChIInChI=1S/C17H17N3O4/c1-23-14-8-7-13(10-19-20-17(22)16(18)21)9-15(14)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,18,21)(H,20,22)/b19-10+
InChIKeyHEQIUFOCYZVZJE-VXLYETTFSA-N
MW327.34 g/mol
LogP1.21
Rot. Bonds6

About N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide

N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide (PubChem CID 6910290) has the molecular formula C17H17N3O4 and a molecular weight of 327.34 g/mol. Its IUPAC name is N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide
PubChem CID6910290
Molecular FormulaC17H17N3O4
Molecular Weight327.34 g/mol
Exact Mass327.12
IUPAC NameN'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide
SMILESCOc1ccc(/C=N/NC(=O)C(N)=O)cc1OCc1ccccc1
InChIInChI=1S/C17H17N3O4/c1-23-14-8-7-13(10-19-20-17(22)16(18)21)9-15(14)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,18,21)(H,20,22)/b19-10+
InChIKeyHEQIUFOCYZVZJE-VXLYETTFSA-N
XLogP1.21
TPSA103.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide 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

ethyl N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]carbamate
CID 6902975
N'-[(Z)-(3-ethoxy-4-methoxyphenyl)methylideneamino]oxamide
CID 9120925
[[3,4-bis(phenylmethoxy)phenyl]methylideneamino]urea
CID 1267665
3,4,5-trimethoxy-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 42991313
N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]furan-2-carboxamide
CID 1389238
ethyl N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]carbamate
CID 6902439
N-[(Z)-[3,4-bis(phenylmethoxy)phenyl]methylideneamino]acetamide
CID 6117131
3-hydroxy-N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 6911475
N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]-1-benzofuran-2-carboxamide
CID 96885314
N-(furan-2-ylmethyl)-N'-[(Z)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide
CID 9352883
N'-[(4-phenylmethoxyphenyl)methylideneamino]oxamide
CID 2692945
3-chloro-N-[(Z)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]benzamide
CID 94847745

Frequently Asked Questions

What is the IUPAC name of N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide?
The IUPAC name of N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide (CID 6910290) is N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide.
What is the SMILES notation for N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide?
The canonical SMILES for N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide is COc1ccc(/C=N/NC(=O)C(N)=O)cc1OCc1ccccc1.
What is the InChIKey of N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide?
The InChIKey is HEQIUFOCYZVZJE-VXLYETTFSA-N. The full InChI is InChI=1S/C17H17N3O4/c1-23-14-8-7-13(10-19-20-17(22)16(18)21)9-15(14)24-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H2,18,21)(H,20,22)/b19-10+.
What are the key properties of N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide?
N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide has a molecular weight of 327.34 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]oxamide is sourced from PubChem (CID 6910290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).