N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide

C17H17N3O4 — CID 2250526

IUPACN-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide
SMILESCOc1ccccc1C=NNC(=O)C(=O)Nc1ccccc1OC
InChIInChI=1S/C17H17N3O4/c1-23-14-9-5-3-7-12(14)11-18-20-17(22)16(21)19-13-8-4-6-10-15(13)24-2/h3-11H,1-2H3,(H,19,21)(H,20,22)
InChIKeyCAIYJXQJQLUEGQ-UHFFFAOYSA-N
MW327.34 g/mol
LogP1.79
Rot. Bonds5

About N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide

N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide (PubChem CID 2250526) has the molecular formula C17H17N3O4 and a molecular weight of 327.34 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide
PubChem CID2250526
Molecular FormulaC17H17N3O4
Molecular Weight327.34 g/mol
Exact Mass327.12
IUPAC NameN-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide
SMILESCOc1ccccc1C=NNC(=O)C(=O)Nc1ccccc1OC
InChIInChI=1S/C17H17N3O4/c1-23-14-9-5-3-7-12(14)11-18-20-17(22)16(21)19-13-8-4-6-10-15(13)24-2/h3-11H,1-2H3,(H,19,21)(H,20,22)
InChIKeyCAIYJXQJQLUEGQ-UHFFFAOYSA-N
XLogP1.79
TPSA89.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 51.79
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'}

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Related Compounds

N-(2,4-dimethoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide
CID 4133149
N-(2-methoxyphenyl)-N'-[(E)-(2-prop-2-ynoxyphenyl)methylideneamino]oxamide
CID 51061190
N-(2-methoxyphenyl)-N'-[(2-nitrophenyl)methylideneamino]oxamide
CID 5108255
[2-[[[2-(2-methoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 3-methoxybenzoate
CID 4586423
1-(2-methoxyphenyl)-3-[(2-methoxyphenyl)methylideneamino]thiourea
CID 2404947
N'-[(E)-(2,4-dichlorophenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 5334540
N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 3615821
N'-[(4-fluorophenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 3102438
N-(4-chloro-2-methylphenyl)-N'-[(Z)-(2-methoxyphenyl)methylideneamino]oxamide
CID 6058233
N-(4-chloro-2-methylphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide
CID 4284877
N'-[(E)-(4-bromophenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 5334344
N'-[(2-hydroxy-3-methoxyphenyl)methylideneamino]-N-(2-methylphenyl)oxamide
CID 5146554

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide?
The IUPAC name of N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide (CID 2250526) is N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide?
The canonical SMILES for N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide is COc1ccccc1C=NNC(=O)C(=O)Nc1ccccc1OC.
What is the InChIKey of N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide?
The InChIKey is CAIYJXQJQLUEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O4/c1-23-14-9-5-3-7-12(14)11-18-20-17(22)16(21)19-13-8-4-6-10-15(13)24-2/h3-11H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide?
N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide has a molecular weight of 327.34 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide is sourced from PubChem (CID 2250526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).