N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide

C14H11BrClN3O2 — CID 108516155

IUPACN'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
SMILESNc1ccc(NC(=O)C(=O)Nc2cccc(Br)c2)cc1Cl
InChIInChI=1S/C14H11BrClN3O2/c15-8-2-1-3-9(6-8)18-13(20)14(21)19-10-4-5-12(17)11(16)7-10/h1-7H,17H2,(H,18,20)(H,19,21)
InChIKeyWZFRYVYAWOGNEZ-UHFFFAOYSA-N
MW368.62 g/mol
LogP3.26
Rot. Bonds2

About N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide

N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide (PubChem CID 108516155) has the molecular formula C14H11BrClN3O2 and a molecular weight of 368.62 g/mol. Its IUPAC name is N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide.

Molecular Properties

Compound NameN'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
PubChem CID108516155
Molecular FormulaC14H11BrClN3O2
Molecular Weight368.62 g/mol
Exact Mass366.97
IUPAC NameN'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
SMILESNc1ccc(NC(=O)C(=O)Nc2cccc(Br)c2)cc1Cl
InChIInChI=1S/C14H11BrClN3O2/c15-8-2-1-3-9(6-8)18-13(20)14(21)19-10-4-5-12(17)11(16)7-10/h1-7H,17H2,(H,18,20)(H,19,21)
InChIKeyWZFRYVYAWOGNEZ-UHFFFAOYSA-N
XLogP3.26
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.62
LogP ≤ 53.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

(Z)-N-(4-amino-3-chlorophenyl)-3-(3-bromoanilino)-2-cyanoprop-2-enamide
CID 108859670
N'-(3-acetylphenyl)-N-(4-amino-3-chlorophenyl)oxamide
CID 108514915
N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
CID 108516241
N'-(3-bromophenyl)-N-(4-chlorophenyl)oxamide
CID 108516651
N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide
CID 108515975
N-(4-amino-3-chlorophenyl)-N'-(3,5-dimethylphenyl)oxamide
CID 108516205
N-(4-amino-3-chlorophenyl)-N'-benzhydryloxamide
CID 108507997
N'-(3-bromophenyl)-N-(4-fluorophenyl)oxamide
CID 108512623
N-(4-amino-3-chlorophenyl)-4-bromo-2-fluorobenzamide
CID 82861279
N-(4-amino-3-chlorophenyl)-3,5-dibromobenzamide
CID 107971082
(4-amino-3-chlorophenyl)carbamic acid
CID 18543733
N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide
CID 108502772

Frequently Asked Questions

What is the IUPAC name of N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide?
The IUPAC name of N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide (CID 108516155) is N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide.
What is the SMILES notation for N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide?
The canonical SMILES for N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide is Nc1ccc(NC(=O)C(=O)Nc2cccc(Br)c2)cc1Cl.
What is the InChIKey of N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide?
The InChIKey is WZFRYVYAWOGNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClN3O2/c15-8-2-1-3-9(6-8)18-13(20)14(21)19-10-4-5-12(17)11(16)7-10/h1-7H,17H2,(H,18,20)(H,19,21).
What are the key properties of N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide?
N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide has a molecular weight of 368.62 g/mol, XLogP of 3.26, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide is sourced from PubChem (CID 108516155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).