N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide

C16H15N3O4 — CID 3615821

IUPACN'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
SMILESCOc1ccccc1NC(=O)C(=O)NN=Cc1ccc(O)cc1
InChIInChI=1S/C16H15N3O4/c1-23-14-5-3-2-4-13(14)18-15(21)16(22)19-17-10-11-6-8-12(20)9-7-11/h2-10,20H,1H3,(H,18,21)(H,19,22)
InChIKeyVILGQUZUFLPKMU-UHFFFAOYSA-N
MW313.31 g/mol
LogP1.49
Rot. Bonds4

About N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide

N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide (PubChem CID 3615821) has the molecular formula C16H15N3O4 and a molecular weight of 313.31 g/mol. Its IUPAC name is N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
PubChem CID3615821
Molecular FormulaC16H15N3O4
Molecular Weight313.31 g/mol
Exact Mass313.11
IUPAC NameN'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
SMILESCOc1ccccc1NC(=O)C(=O)NN=Cc1ccc(O)cc1
InChIInChI=1S/C16H15N3O4/c1-23-14-5-3-2-4-13(14)18-15(21)16(22)19-17-10-11-6-8-12(20)9-7-11/h2-10,20H,1H3,(H,18,21)(H,19,22)
InChIKeyVILGQUZUFLPKMU-UHFFFAOYSA-N
XLogP1.49
TPSA100.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.31
LogP ≤ 51.49
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

N'-[(4-fluorophenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 3102438
N'-[(E)-(4-bromophenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 5334344
4-[[[2-(2-methoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoic acid
CID 2248354
N'-[(E)-(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)butanediamide
CID 135788644
N-(2,5-dimethoxyphenyl)-N'-[(E)-(4-hydroxyphenyl)methylideneamino]oxamide
CID 135554167
N-(2-methoxyphenyl)-N'-[(2-methoxyphenyl)methylideneamino]oxamide
CID 2250526
2-[4-[[[2-(2-methoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenoxy]acetic acid
CID 4097734
N'-[(Z)-[4-[(4-bromophenyl)methoxy]phenyl]methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 94848768
[4-[[[2-(2-methoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate
CID 3615817
N-(2-ethoxyphenyl)-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]oxamide
CID 135554201
N'-[(Z)-(3-chloro-4-ethoxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide
CID 8931569
N'-[(E)-(4-hydroxyphenyl)methylideneamino]-N-(4-methoxyphenyl)oxamide
CID 135583538

Frequently Asked Questions

What is the IUPAC name of N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide?
The IUPAC name of N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide (CID 3615821) is N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide.
What is the SMILES notation for N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide?
The canonical SMILES for N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide is COc1ccccc1NC(=O)C(=O)NN=Cc1ccc(O)cc1.
What is the InChIKey of N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide?
The InChIKey is VILGQUZUFLPKMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O4/c1-23-14-5-3-2-4-13(14)18-15(21)16(22)19-17-10-11-6-8-12(20)9-7-11/h2-10,20H,1H3,(H,18,21)(H,19,22).
What are the key properties of N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide?
N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide has a molecular weight of 313.31 g/mol, XLogP of 1.49, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(4-hydroxyphenyl)methylideneamino]-N-(2-methoxyphenyl)oxamide is sourced from PubChem (CID 3615821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).