N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide

C17H18N2O2 — CID 44995959

IUPACN'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2cc(C)ccc2C)cc1
InChIInChI=1S/C17H18N2O2/c1-11-5-8-14(9-6-11)18-16(20)17(21)19-15-10-12(2)4-7-13(15)3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyBWPILYZZFAKVSC-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.19
Rot. Bonds2

About N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide

N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide (PubChem CID 44995959) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide.

Molecular Properties

Compound NameN'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide
PubChem CID44995959
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide
SMILESCc1ccc(NC(=O)C(=O)Nc2cc(C)ccc2C)cc1
InChIInChI=1S/C17H18N2O2/c1-11-5-8-14(9-6-11)18-16(20)17(21)19-15-10-12(2)4-7-13(15)3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyBWPILYZZFAKVSC-UHFFFAOYSA-N
XLogP3.19
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-bromo-3-methylphenyl)-N'-(2,5-dimethylphenyl)oxamide
CID 108531024
N-(3-acetamidophenyl)-N'-(2,5-dimethylphenyl)oxamide
CID 45001294
N'-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)oxamide
CID 45000850
N'-(2,5-dimethylphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]oxamide
CID 108531006
N'-(2,5-dimethylphenyl)-N-(2-hydroxyphenyl)oxamide
CID 108514348
1-(2,5-dimethylphenyl)-3-[4-(4-hydroxyphenyl)phenyl]urea
CID 168974118
1-(4-bromophenyl)-3-(2,5-dimethylphenyl)urea
CID 108869298
N'-(2-amino-5-methylphenyl)-N-(4-hydroxyphenyl)oxamide
CID 108502143
N-(3,4-dimethylphenyl)-N'-(2-hydroxy-4-methylphenyl)oxamide
CID 108523165
6-N-(2,5-dimethylphenyl)-2-N-(4-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100172
N,N'-bis(2,4-dimethylphenyl)oxamide
CID 3416969
N-(3-bromo-4-methylphenyl)-N'-(2,4-dimethylphenyl)oxamide
CID 108986806

Frequently Asked Questions

What is the IUPAC name of N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide?
The IUPAC name of N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide (CID 44995959) is N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide.
What is the SMILES notation for N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide?
The canonical SMILES for N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide is Cc1ccc(NC(=O)C(=O)Nc2cc(C)ccc2C)cc1.
What is the InChIKey of N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide?
The InChIKey is BWPILYZZFAKVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-11-5-8-14(9-6-11)18-16(20)17(21)19-15-10-12(2)4-7-13(15)3/h4-10H,1-3H3,(H,18,20)(H,19,21).
What are the key properties of N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide?
N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide has a molecular weight of 282.34 g/mol, XLogP of 3.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide is sourced from PubChem (CID 44995959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).