N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide

C10H11N3O2 — CID 6248388

IUPACN'-[(Z)-(4-methylphenyl)methylideneamino]oxamide
SMILESCc1ccc(/C=N\NC(=O)C(N)=O)cc1
InChIInChI=1S/C10H11N3O2/c1-7-2-4-8(5-3-7)6-12-13-10(15)9(11)14/h2-6H,1H3,(H2,11,14)(H,13,15)/b12-6-
InChIKeyLSXSOIWGTPZHGG-SDQBBNPISA-N
MW205.22 g/mol
LogP-0.07
Rot. Bonds2

About N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide

N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide (PubChem CID 6248388) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN'-[(Z)-(4-methylphenyl)methylideneamino]oxamide
PubChem CID6248388
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC NameN'-[(Z)-(4-methylphenyl)methylideneamino]oxamide
SMILESCc1ccc(/C=N\NC(=O)C(N)=O)cc1
InChIInChI=1S/C10H11N3O2/c1-7-2-4-8(5-3-7)6-12-13-10(15)9(11)14/h2-6H,1H3,(H2,11,14)(H,13,15)/b12-6-
InChIKeyLSXSOIWGTPZHGG-SDQBBNPISA-N
XLogP-0.07
TPSA84.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'-[(4-methoxyphenyl)methylideneamino]oxamide
CID 2590460
1-[(4-methylphenyl)methylideneamino]-2-[(E)-(4-methylphenyl)methylideneamino]guanidine
CID 11963576
4-[[[2-(4-methylanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoic acid
CID 3825243
N'-[(4-hexoxyphenyl)methylideneamino]oxamide
CID 2590490
N'-[(Z)-(6-methoxynaphthalen-2-yl)methylideneamino]oxamide
CID 9120780
2-(5-aminotetrazol-1-yl)-N-[(E)-(4-methylphenyl)methylideneamino]acetamide
CID 5334953
N'-[(Z)-(3,4-difluorophenyl)methylideneamino]-N-(4-methylphenyl)oxamide
CID 9180073
N-(2-bromophenyl)-N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide
CID 6273720
2-ethyl-N,N'-bis[(E)-(4-methylphenyl)methylideneamino]propanediamide
CID 45356627
N-[(Z)-(4-fluorophenyl)methylideneamino]-4-methylbenzamide
CID 5405739
4-hydroxy-N-[(4-methylphenyl)methylideneamino]benzamide
CID 789070
N-[(Z)-[4-(4-methylphenyl)sulfanylphenyl]methylideneamino]acetamide
CID 126249111

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide?
The IUPAC name of N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide (CID 6248388) is N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide.
What is the SMILES notation for N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide?
The canonical SMILES for N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide is Cc1ccc(/C=N\NC(=O)C(N)=O)cc1.
What is the InChIKey of N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide?
The InChIKey is LSXSOIWGTPZHGG-SDQBBNPISA-N. The full InChI is InChI=1S/C10H11N3O2/c1-7-2-4-8(5-3-7)6-12-13-10(15)9(11)14/h2-6H,1H3,(H2,11,14)(H,13,15)/b12-6-.
What are the key properties of N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide?
N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide has a molecular weight of 205.22 g/mol, XLogP of -0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide is sourced from PubChem (CID 6248388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).