N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide

C18H19N3O2 — CID 8898860

IUPACN-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide
SMILESCCc1ccccc1NC(=O)C(=O)N/N=C\c1ccccc1C
InChIInChI=1S/C18H19N3O2/c1-3-14-9-6-7-11-16(14)20-17(22)18(23)21-19-12-15-10-5-4-8-13(15)2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)/b19-12-
InChIKeyKAHHHWGVEHSUCQ-UNOMPAQXSA-N
MW309.37 g/mol
LogP2.65
Rot. Bonds4

About N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide

N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide (PubChem CID 8898860) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide
PubChem CID8898860
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide
SMILESCCc1ccccc1NC(=O)C(=O)N/N=C\c1ccccc1C
InChIInChI=1S/C18H19N3O2/c1-3-14-9-6-7-11-16(14)20-17(22)18(23)21-19-12-15-10-5-4-8-13(15)2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)/b19-12-
InChIKeyKAHHHWGVEHSUCQ-UNOMPAQXSA-N
XLogP2.65
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.65
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-(2-fluorophenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide
CID 8898803
N-(2-ethylphenyl)-N'-[(E)-(3-methylthiophen-2-yl)methylideneamino]oxamide
CID 19659662
N-(2-ethylphenyl)-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylideneamino]oxamide
CID 135554301
N'-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-N-(2-ethylphenyl)oxamide
CID 135615725
N-(2-ethylphenyl)-N'-[(4-fluorophenyl)methylideneamino]oxamide
CID 4642668
N'-[[2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-ethylphenyl)oxamide
CID 4319718
N-(2-ethylphenyl)-N'-[(4-methoxyphenyl)methylideneamino]oxamide
CID 3318922
N-(4-bromophenyl)-N'-[(2-methylphenyl)methylideneamino]oxamide
CID 3672050
N'-[(Z)-[2-[2-(2-ethylanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(2-fluorophenyl)oxamide
CID 126266532
N-(2-ethylphenyl)-N'-(2-phenylethylideneamino)oxamide
CID 4656715
N'-[[2-[(2-chlorophenyl)methoxy]phenyl]methylideneamino]-N-(2-methylphenyl)oxamide
CID 4005945
N-(2-ethylphenyl)-N'-[(Z)-(4-propoxyphenyl)methylideneamino]oxamide
CID 8988931

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide?
The IUPAC name of N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide (CID 8898860) is N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide.
What is the SMILES notation for N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide?
The canonical SMILES for N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide is CCc1ccccc1NC(=O)C(=O)N/N=C\c1ccccc1C.
What is the InChIKey of N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide?
The InChIKey is KAHHHWGVEHSUCQ-UNOMPAQXSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-3-14-9-6-7-11-16(14)20-17(22)18(23)21-19-12-15-10-5-4-8-13(15)2/h4-12H,3H2,1-2H3,(H,20,22)(H,21,23)/b19-12-.
What are the key properties of N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide?
N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide has a molecular weight of 309.37 g/mol, XLogP of 2.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-N'-[(Z)-(2-methylphenyl)methylideneamino]oxamide is sourced from PubChem (CID 8898860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).