N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide

C14H10Cl3N3O2 — CID 108502772

IUPACN-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide
SMILESNc1ccc(NC(=O)C(=O)Nc2ccc(Cl)cc2Cl)cc1Cl
InChIInChI=1S/C14H10Cl3N3O2/c15-7-1-4-12(10(17)5-7)20-14(22)13(21)19-8-2-3-11(18)9(16)6-8/h1-6H,18H2,(H,19,21)(H,20,22)
InChIKeyNVKXXIOIKIKKNY-UHFFFAOYSA-N
MW358.61 g/mol
LogP3.81
Rot. Bonds2

About N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide

N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide (PubChem CID 108502772) has the molecular formula C14H10Cl3N3O2 and a molecular weight of 358.61 g/mol. Its IUPAC name is N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide.

Molecular Properties

Compound NameN-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide
PubChem CID108502772
Molecular FormulaC14H10Cl3N3O2
Molecular Weight358.61 g/mol
Exact Mass356.98
IUPAC NameN-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide
SMILESNc1ccc(NC(=O)C(=O)Nc2ccc(Cl)cc2Cl)cc1Cl
InChIInChI=1S/C14H10Cl3N3O2/c15-7-1-4-12(10(17)5-7)20-14(22)13(21)19-8-2-3-11(18)9(16)6-8/h1-6H,18H2,(H,19,21)(H,20,22)
InChIKeyNVKXXIOIKIKKNY-UHFFFAOYSA-N
XLogP3.81
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.61
LogP ≤ 53.81
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

N-(4-amino-3-chlorophenyl)-N'-(5-chloro-2-hydroxyphenyl)oxamide
CID 108515977
N-(4-amino-3-chlorophenyl)-N'-(5-chloro-2-methoxyphenyl)oxamide
CID 108502189
N-(4-amino-3-chlorophenyl)-N'-(3,5-dimethylphenyl)oxamide
CID 108516205
N-(2-amino-4-methylphenyl)-N'-(2,4-dichlorophenyl)oxamide
CID 108502956
N'-(2,4-dichlorophenyl)-N-(4-nitrophenyl)oxamide
CID 108502754
N-(2,4-dichlorophenyl)-N'-(3,5-dimethylphenyl)oxamide
CID 108502902
1-(4-amino-3-chlorophenyl)-3-(2,5-dichlorophenyl)urea
CID 82861443
(4-amino-3-chlorophenyl)carbamic acid
CID 18543733
N'-(4-amino-3-chlorophenyl)-N-(3-bromophenyl)oxamide
CID 108516155
N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
CID 108516241
N'-(3-acetylphenyl)-N-(4-amino-3-chlorophenyl)oxamide
CID 108514915
N-(4-amino-3-chlorophenyl)-N'-benzhydryloxamide
CID 108507997

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide?
The IUPAC name of N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide (CID 108502772) is N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide.
What is the SMILES notation for N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide?
The canonical SMILES for N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide is Nc1ccc(NC(=O)C(=O)Nc2ccc(Cl)cc2Cl)cc1Cl.
What is the InChIKey of N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide?
The InChIKey is NVKXXIOIKIKKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3N3O2/c15-7-1-4-12(10(17)5-7)20-14(22)13(21)19-8-2-3-11(18)9(16)6-8/h1-6H,18H2,(H,19,21)(H,20,22).
What are the key properties of N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide?
N-(4-amino-3-chlorophenyl)-N'-(2,4-dichlorophenyl)oxamide has a molecular weight of 358.61 g/mol, XLogP of 3.81, 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'-(2,4-dichlorophenyl)oxamide is sourced from PubChem (CID 108502772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).