N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide

C15H10Cl2FN3O2 — CID 6084385

IUPACN'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide
SMILESO=C(N/N=C\c1ccc(Cl)cc1Cl)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H10Cl2FN3O2/c16-10-2-1-9(13(17)7-10)8-19-21-15(23)14(22)20-12-5-3-11(18)4-6-12/h1-8H,(H,20,22)(H,21,23)/b19-8-
InChIKeyGVJCEZZBWRYUPM-UWVJOHFNSA-N
MW354.17 g/mol
LogP3.22
Rot. Bonds3

About N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide

N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide (PubChem CID 6084385) has the molecular formula C15H10Cl2FN3O2 and a molecular weight of 354.17 g/mol. Its IUPAC name is N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide.

Molecular Properties

Compound NameN'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide
PubChem CID6084385
Molecular FormulaC15H10Cl2FN3O2
Molecular Weight354.17 g/mol
Exact Mass353.01
IUPAC NameN'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide
SMILESO=C(N/N=C\c1ccc(Cl)cc1Cl)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C15H10Cl2FN3O2/c16-10-2-1-9(13(17)7-10)8-19-21-15(23)14(22)20-12-5-3-11(18)4-6-12/h1-8H,(H,20,22)(H,21,23)/b19-8-
InChIKeyGVJCEZZBWRYUPM-UWVJOHFNSA-N
XLogP3.22
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.17
LogP ≤ 53.22
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-[(E)-(2,4-dichlorophenyl)methylideneamino]-4-[(4-fluorobenzoyl)amino]benzamide
CID 86809567
N-(4-carbamoylphenyl)-N'-[(E)-(2,4-dichlorophenyl)methylideneamino]oxamide
CID 19660758
N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-nitrophenyl)oxamide
CID 94833575
N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-phenoxyphenyl)oxamide
CID 94846395
N'-[(2,4-dichlorophenyl)methylideneamino]-N-(4-ethoxyphenyl)oxamide
CID 2244299
N'-[(Z)-(5-chloro-2-nitrophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide
CID 6049220
N-(5-chloro-2-methylphenyl)-N'-[(E)-(2,4-dichlorophenyl)methylideneamino]oxamide
CID 56698653
N'-[(E)-(2,4-dihydroxyphenyl)methylideneamino]-N-(4-fluorophenyl)oxamide
CID 135684849
4-[(4-chlorobenzoyl)amino]-N-[(Z)-(2,4-dichlorophenyl)methylideneamino]benzamide
CID 94836336
N'-[(E)-(2,4-dichlorophenyl)methylideneamino]-N-(2,4,6-trimethylphenyl)oxamide
CID 6871449
N-[2-[(4-bromophenyl)carbamoyl]phenyl]-N'-[(2,4-dichlorophenyl)methylideneamino]oxamide
CID 4549616
N'-[(2,4-dichlorophenyl)methylideneamino]-N-(2,5-dimethylphenyl)oxamide
CID 3426233

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide?
The IUPAC name of N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide (CID 6084385) is N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide.
What is the SMILES notation for N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide?
The canonical SMILES for N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide is O=C(N/N=C\c1ccc(Cl)cc1Cl)C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide?
The InChIKey is GVJCEZZBWRYUPM-UWVJOHFNSA-N. The full InChI is InChI=1S/C15H10Cl2FN3O2/c16-10-2-1-9(13(17)7-10)8-19-21-15(23)14(22)20-12-5-3-11(18)4-6-12/h1-8H,(H,20,22)(H,21,23)/b19-8-.
What are the key properties of N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide?
N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide has a molecular weight of 354.17 g/mol, XLogP of 3.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-(4-fluorophenyl)oxamide is sourced from PubChem (CID 6084385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).