N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide

C15H10BrCl2N3O2 — CID 94847083

IUPACN-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide
SMILESO=C(N/N=C\c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1Br
InChIInChI=1S/C15H10BrCl2N3O2/c16-10-4-1-2-7-13(10)20-14(22)15(23)21-19-8-9-11(17)5-3-6-12(9)18/h1-8H,(H,20,22)(H,21,23)/b19-8-
InChIKeyAYLFDIQPDBUJLY-UWVJOHFNSA-N
MW415.07 g/mol
LogP3.84
Rot. Bonds3

About N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide

N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide (PubChem CID 94847083) has the molecular formula C15H10BrCl2N3O2 and a molecular weight of 415.07 g/mol. Its IUPAC name is N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide
PubChem CID94847083
Molecular FormulaC15H10BrCl2N3O2
Molecular Weight415.07 g/mol
Exact Mass412.93
IUPAC NameN-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide
SMILESO=C(N/N=C\c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1Br
InChIInChI=1S/C15H10BrCl2N3O2/c16-10-4-1-2-7-13(10)20-14(22)15(23)21-19-8-9-11(17)5-3-6-12(9)18/h1-8H,(H,20,22)(H,21,23)/b19-8-
InChIKeyAYLFDIQPDBUJLY-UWVJOHFNSA-N
XLogP3.84
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.07
LogP ≤ 53.84
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-bromophenyl)methylideneamino]-N-(2-chlorophenyl)oxamide
CID 4668283
N'-[(E)-(2,6-dichlorophenyl)methylideneamino]-N-phenyloxamide
CID 51060164
N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]-N-[2-[(3-methylphenyl)carbamoyl]phenyl]oxamide
CID 6028561
N-(2-bromophenyl)-N'-[(Z)-(4-methylphenyl)methylideneamino]oxamide
CID 6273720
N-(2-bromophenyl)-N'-[(Z)-[1-(2-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]oxamide
CID 94836922
2-[(Z)-[[2-(2-bromoanilino)-2-oxoacetyl]hydrazinylidene]methyl]benzoate
CID 7323591
N-(4-carbamoylphenyl)-N'-[(2,6-dichlorophenyl)methylideneamino]oxamide
CID 3527403
N-(2-chlorophenyl)-N'-[(E)-(3-chlorophenyl)methylideneamino]oxamide
CID 6871246
N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]-N-[3-(trifluoromethyl)phenyl]oxamide
CID 7738333
N-(2-bromophenyl)-N'-[(2-hydroxy-3-methoxyphenyl)methylideneamino]oxamide
CID 4029992
(E)-N-(2-bromophenyl)-3-(2,6-dichlorophenyl)prop-2-enamide
CID 1001666
N-(2-chlorophenyl)-N'-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]oxamide
CID 136815761

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide?
The IUPAC name of N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide (CID 94847083) is N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide.
What is the SMILES notation for N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide?
The canonical SMILES for N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide is O=C(N/N=C\c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide?
The InChIKey is AYLFDIQPDBUJLY-UWVJOHFNSA-N. The full InChI is InChI=1S/C15H10BrCl2N3O2/c16-10-4-1-2-7-13(10)20-14(22)15(23)21-19-8-9-11(17)5-3-6-12(9)18/h1-8H,(H,20,22)(H,21,23)/b19-8-.
What are the key properties of N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide?
N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide has a molecular weight of 415.07 g/mol, XLogP of 3.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-N'-[(Z)-(2,6-dichlorophenyl)methylideneamino]oxamide is sourced from PubChem (CID 94847083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).