N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide

C16H15ClN2O2 — CID 108516687

IUPACN-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide
SMILESCc1cccc(C)c1NC(=O)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H15ClN2O2/c1-10-4-3-5-11(2)14(10)19-16(21)15(20)18-13-8-6-12(17)7-9-13/h3-9H,1-2H3,(H,18,20)(H,19,21)
InChIKeyOKXUARPCOPRWPP-UHFFFAOYSA-N
MW302.76 g/mol
LogP3.53
Rot. Bonds2

About N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide

N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide (PubChem CID 108516687) has the molecular formula C16H15ClN2O2 and a molecular weight of 302.76 g/mol. Its IUPAC name is N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide
PubChem CID108516687
Molecular FormulaC16H15ClN2O2
Molecular Weight302.76 g/mol
Exact Mass302.08
IUPAC NameN-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide
SMILESCc1cccc(C)c1NC(=O)C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H15ClN2O2/c1-10-4-3-5-11(2)14(10)19-16(21)15(20)18-13-8-6-12(17)7-9-13/h3-9H,1-2H3,(H,18,20)(H,19,21)
InChIKeyOKXUARPCOPRWPP-UHFFFAOYSA-N
XLogP3.53
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 53.53
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-(4-chlorophenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512199
N,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
N'-(2,6-dimethylphenyl)-N-(4-sulfamoylphenyl)oxamide
CID 108508841
N-(4-bromo-3-methylphenyl)-N'-(2,6-dimethylphenyl)oxamide
CID 108532418
N'-(2,6-dimethylphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]oxamide
CID 108527636
N-(2,6-dimethylphenyl)-N'-(2,4,6-trimethylphenyl)oxamide
CID 108512317
N-(4-chlorophenyl)-2-oxopropanamide
CID 4252596
N-(4-chlorophenyl)-2,6-dimethylaniline
CID 10977319
N'-(2,6-dimethylphenyl)-N-(3-fluorophenyl)oxamide
CID 108531930
N-(4-chlorophenyl)-2-hydroxy-6-methylbenzamide
CID 46215145
N-[2-[(4-chlorophenyl)carbamoylamino]-6-methylphenyl]-2-methylpropanamide
CID 6472575
N-(4-acetylphenyl)-N'-(4-chlorophenyl)oxamide
CID 108514724

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide?
The IUPAC name of N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide (CID 108516687) is N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide.
What is the SMILES notation for N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide?
The canonical SMILES for N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide is Cc1cccc(C)c1NC(=O)C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide?
The InChIKey is OKXUARPCOPRWPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O2/c1-10-4-3-5-11(2)14(10)19-16(21)15(20)18-13-8-6-12(17)7-9-13/h3-9H,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide?
N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide has a molecular weight of 302.76 g/mol, XLogP of 3.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-N'-(2,6-dimethylphenyl)oxamide is sourced from PubChem (CID 108516687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).