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

C10H11N3O3 — CID 2590460

IUPACN'-[(4-methoxyphenyl)methylideneamino]oxamide
SMILESCOc1ccc(C=NNC(=O)C(N)=O)cc1
InChIInChI=1S/C10H11N3O3/c1-16-8-4-2-7(3-5-8)6-12-13-10(15)9(11)14/h2-6H,1H3,(H2,11,14)(H,13,15)
InChIKeyQCBAMRDAYNQQGN-UHFFFAOYSA-N
MW221.22 g/mol
LogP-0.37
Rot. Bonds3

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

N'-[(4-methoxyphenyl)methylideneamino]oxamide (PubChem CID 2590460) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is N'-[(4-methoxyphenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN'-[(4-methoxyphenyl)methylideneamino]oxamide
PubChem CID2590460
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC NameN'-[(4-methoxyphenyl)methylideneamino]oxamide
SMILESCOc1ccc(C=NNC(=O)C(N)=O)cc1
InChIInChI=1S/C10H11N3O3/c1-16-8-4-2-7(3-5-8)6-12-13-10(15)9(11)14/h2-6H,1H3,(H2,11,14)(H,13,15)
InChIKeyQCBAMRDAYNQQGN-UHFFFAOYSA-N
XLogP-0.37
TPSA93.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'-[(Z)-(6-methoxynaphthalen-2-yl)methylideneamino]oxamide
CID 9120780
N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide
CID 6248388
N-[(E)-(4-methoxyphenyl)methylideneamino]-N'-[(Z)-(4-methoxyphenyl)methylideneamino]propanediamide
CID 44726282
N',N'-diethyl-N-[(4-methoxyphenyl)methylideneamino]oxamide
CID 5115674
N,N'-bis[(E)-(4-methoxyphenyl)methylideneamino]butanediamide
CID 6869271
N'-[(E)-(2,4-dimethoxyphenyl)methylideneamino]oxamide
CID 6907755
N'-[(E)-(4-hydroxyphenyl)methylideneamino]-N-(4-methoxyphenyl)oxamide
CID 135583538
N'-[(4-hexoxyphenyl)methylideneamino]oxamide
CID 2590490
N,N'-bis[(E)-(4-methoxyphenyl)methylideneamino]pentanediamide
CID 6861549
[4-[(Z)-(carbamoylhydrazinylidene)methyl]phenyl] 4-methoxybenzoate
CID 5416155
N-[(4-methoxyphenyl)methylideneamino]-2-oxo-2-pyrrolidin-1-ylacetamide
CID 3102338
1,2-bis[(E)-(4-methoxyphenyl)methylideneamino]guanidine
CID 54753081

Frequently Asked Questions

What is the IUPAC name of N'-[(4-methoxyphenyl)methylideneamino]oxamide?
The IUPAC name of N'-[(4-methoxyphenyl)methylideneamino]oxamide (CID 2590460) is N'-[(4-methoxyphenyl)methylideneamino]oxamide.
What is the SMILES notation for N'-[(4-methoxyphenyl)methylideneamino]oxamide?
The canonical SMILES for N'-[(4-methoxyphenyl)methylideneamino]oxamide is COc1ccc(C=NNC(=O)C(N)=O)cc1.
What is the InChIKey of N'-[(4-methoxyphenyl)methylideneamino]oxamide?
The InChIKey is QCBAMRDAYNQQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c1-16-8-4-2-7(3-5-8)6-12-13-10(15)9(11)14/h2-6H,1H3,(H2,11,14)(H,13,15).
What are the key properties of N'-[(4-methoxyphenyl)methylideneamino]oxamide?
N'-[(4-methoxyphenyl)methylideneamino]oxamide has a molecular weight of 221.22 g/mol, XLogP of -0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(4-methoxyphenyl)methylideneamino]oxamide is sourced from PubChem (CID 2590460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).