N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide

C15H11Cl3N2O2 — CID 108506161

IUPACN-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide
SMILESO=C(NCc1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H11Cl3N2O2/c16-10-5-11(17)7-12(6-10)20-15(22)14(21)19-8-9-3-1-2-4-13(9)18/h1-7H,8H2,(H,19,21)(H,20,22)
InChIKeyWFTFMTZICMWJQG-UHFFFAOYSA-N
MW357.62 g/mol
LogP3.90
Rot. Bonds3

About N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide

N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide (PubChem CID 108506161) has the molecular formula C15H11Cl3N2O2 and a molecular weight of 357.62 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide
PubChem CID108506161
Molecular FormulaC15H11Cl3N2O2
Molecular Weight357.62 g/mol
Exact Mass355.99
IUPAC NameN-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide
SMILESO=C(NCc1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H11Cl3N2O2/c16-10-5-11(17)7-12(6-10)20-15(22)14(21)19-8-9-3-1-2-4-13(9)18/h1-7H,8H2,(H,19,21)(H,20,22)
InChIKeyWFTFMTZICMWJQG-UHFFFAOYSA-N
XLogP3.90
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.62
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-[3,5-bis(trifluoromethyl)phenyl]-N-[(2-chlorophenyl)methyl]oxamide
CID 108506154
N'-(4-anilinophenyl)-N-[(2-chlorophenyl)methyl]oxamide
CID 108506114
2-[(2-chlorophenyl)methylamino]-N-(3,5-dichlorophenyl)acetamide
CID 54832861
methyl 4-[[2-[(2-chlorophenyl)methylamino]-2-oxoacetyl]amino]benzoate
CID 7585238
N-[(2-chlorophenyl)methyl]-N'-(2-ethylphenyl)oxamide
CID 2266307
1-(3-chlorophenyl)-3-[(2-chlorophenyl)methyl]urea
CID 727865
N'-(3-chlorophenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 2174354
N-[(2-chlorophenyl)methyl]-N'-(1,3-dimethyl-2-oxobenzimidazol-5-yl)oxamide
CID 49295823
N'-(3,5-dichlorophenyl)-N-(2-ethylphenyl)oxamide
CID 108530358
N-[(2-chlorophenyl)methyl]-N'-[2-(trifluoromethyl)phenyl]oxamide
CID 45000500
N'-(2-chlorophenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 2174333
N-[2-(4-chlorophenyl)ethyl]-N'-[(2-chlorophenyl)methyl]oxamide
CID 18588832

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide (CID 108506161) is N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide is O=C(NCc1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide?
The InChIKey is WFTFMTZICMWJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl3N2O2/c16-10-5-11(17)7-12(6-10)20-15(22)14(21)19-8-9-3-1-2-4-13(9)18/h1-7H,8H2,(H,19,21)(H,20,22).
What are the key properties of N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide?
N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide has a molecular weight of 357.62 g/mol, XLogP of 3.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-N'-(3,5-dichlorophenyl)oxamide is sourced from PubChem (CID 108506161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).