N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide

C18H19N3O4 — CID 135554232

IUPACN-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide
SMILESCCOc1ccc(NC(=O)C(=O)N/N=C(\C)c2ccc(O)cc2)cc1
InChIInChI=1S/C18H19N3O4/c1-3-25-16-10-6-14(7-11-16)19-17(23)18(24)21-20-12(2)13-4-8-15(22)9-5-13/h4-11,22H,3H2,1-2H3,(H,19,23)(H,21,24)/b20-12+
InChIKeyIZAIOEXVUBOSQA-UDWIEESQSA-N
MW341.37 g/mol
LogP2.27
Rot. Bonds5

About N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide

N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide (PubChem CID 135554232) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide
PubChem CID135554232
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC NameN-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide
SMILESCCOc1ccc(NC(=O)C(=O)N/N=C(\C)c2ccc(O)cc2)cc1
InChIInChI=1S/C18H19N3O4/c1-3-25-16-10-6-14(7-11-16)19-17(23)18(24)21-20-12(2)13-4-8-15(22)9-5-13/h4-11,22H,3H2,1-2H3,(H,19,23)(H,21,24)/b20-12+
InChIKeyIZAIOEXVUBOSQA-UDWIEESQSA-N
XLogP2.27
TPSA100.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'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

[4-[N-[[2-(4-ethoxyanilino)-2-oxoacetyl]amino]-C-methylcarbonimidoyl]phenyl] 4-methylbenzoate
CID 5051283
N'-[1-(2,4-dihydroxyphenyl)ethylideneamino]-N-(4-ethoxyphenyl)oxamide
CID 4072889
N-(4-acetylphenyl)-N'-(4-ethoxyphenyl)oxamide
CID 108514413
4-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 13388921
N-(4-methoxyphenyl)-N'-[1-(4-methylphenyl)ethylideneamino]oxamide
CID 3377445
N-(3,4-dimethylphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide
CID 135659478
N-(4-bromophenyl)-N'-[(E)-1-[4-[(2-methylphenyl)methoxy]phenyl]ethylideneamino]oxamide
CID 19660675
N-(4-chlorophenyl)-N'-[(E)-1-(4-methoxyphenyl)ethylideneamino]oxamide
CID 19661028
N-(4-carbamoylphenyl)-N'-(4-ethoxyphenyl)oxamide
CID 45001359
N-[(Z)-1-(4-aminophenyl)ethylideneamino]-4-ethoxybenzamide
CID 6375501
N-(3-chloro-4-methylphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide
CID 135722639
N-(4-ethoxyphenyl)-N'-[(E)-4-phenylbutan-2-ylideneamino]oxamide
CID 7700055

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide?
The IUPAC name of N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide (CID 135554232) is N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide is CCOc1ccc(NC(=O)C(=O)N/N=C(\C)c2ccc(O)cc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide?
The InChIKey is IZAIOEXVUBOSQA-UDWIEESQSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-3-25-16-10-6-14(7-11-16)19-17(23)18(24)21-20-12(2)13-4-8-15(22)9-5-13/h4-11,22H,3H2,1-2H3,(H,19,23)(H,21,24)/b20-12+.
What are the key properties of N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide?
N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide has a molecular weight of 341.37 g/mol, XLogP of 2.27, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-N'-[(E)-1-(4-hydroxyphenyl)ethylideneamino]oxamide is sourced from PubChem (CID 135554232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).