N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide

C15H11Cl2N3O2 — CID 6871246

IUPACN-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide
SMILESO=C(N/N=C/c1cccc(Cl)c1)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C15H11Cl2N3O2/c16-11-5-3-4-10(8-11)9-18-20-15(22)14(21)19-13-7-2-1-6-12(13)17/h1-9H,(H,19,21)(H,20,22)/b18-9+
InChIKeyFIINAEMLIMYSIW-GIJQJNRQSA-N
MW336.18 g/mol
LogP3.08
Rot. Bonds3

About N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide

N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide (PubChem CID 6871246) has the molecular formula C15H11Cl2N3O2 and a molecular weight of 336.18 g/mol. Its IUPAC name is N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide
PubChem CID6871246
Molecular FormulaC15H11Cl2N3O2
Molecular Weight336.18 g/mol
Exact Mass335.02
IUPAC NameN-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide
SMILESO=C(N/N=C/c1cccc(Cl)c1)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C15H11Cl2N3O2/c16-11-5-3-4-10(8-11)9-18-20-15(22)14(21)19-13-7-2-1-6-12(13)17/h1-9H,(H,19,21)(H,20,22)/b18-9+
InChIKeyFIINAEMLIMYSIW-GIJQJNRQSA-N
XLogP3.08
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.18
LogP ≤ 53.08
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'-[(3-chlorophenyl)methylideneamino]-N-naphthalen-1-yloxamide
CID 75087504
2-(2-chloroanilino)-N-[(Z)-(3-chlorophenyl)methylideneamino]acetamide
CID 5427729
N-(2-chlorophenyl)-N'-[(3,4-dimethoxyphenyl)methylideneamino]oxamide
CID 4992748
N'-[(Z)-[3-[2-(4-chloroanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(2-chlorophenyl)oxamide
CID 126171597
2-chloro-N-[(3-chlorophenyl)methylideneamino]benzamide
CID 689911
N-(2-chlorophenyl)-N'-[(E)-(4-propan-2-ylphenyl)methylideneamino]oxamide
CID 46741746
N-(2-chlorophenyl)-N'-[(Z)-(3,4-diethoxyphenyl)methylideneamino]oxamide
CID 8931980
[4-[(Z)-[[2-(2-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
CID 6060453
2-[2-chloro-4-[(Z)-[[2-(2-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenoxy]acetic acid
CID 8989828
N-(3-chloro-2-methylphenyl)-N'-[(4-chlorophenyl)methylideneamino]oxamide
CID 3686898
N-(3-chlorophenyl)-N'-[(Z)-(3-hydroxyphenyl)methylideneamino]oxamide
CID 94848465
N'-[(2-bromophenyl)methylideneamino]-N-(2-chlorophenyl)oxamide
CID 4668283

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide?
The IUPAC name of N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide (CID 6871246) is N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide.
What is the SMILES notation for N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide?
The canonical SMILES for N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide is O=C(N/N=C/c1cccc(Cl)c1)C(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide?
The InChIKey is FIINAEMLIMYSIW-GIJQJNRQSA-N. The full InChI is InChI=1S/C15H11Cl2N3O2/c16-11-5-3-4-10(8-11)9-18-20-15(22)14(21)19-13-7-2-1-6-12(13)17/h1-9H,(H,19,21)(H,20,22)/b18-9+.
What are the key properties of N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide?
N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide has a molecular weight of 336.18 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide is sourced from PubChem (CID 6871246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).