N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide

C17H18N2O3 — CID 7292696

IUPACN'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
SMILESCOc1ccc(NC(=O)C(=O)NCc2ccccc2C)cc1
InChIInChI=1S/C17H18N2O3/c1-12-5-3-4-6-13(12)11-18-16(20)17(21)19-14-7-9-15(22-2)10-8-14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyWSOQKHSSJITSKM-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.26
Rot. Bonds4

About N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide

N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide (PubChem CID 7292696) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide.

Molecular Properties

Compound NameN'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
PubChem CID7292696
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
SMILESCOc1ccc(NC(=O)C(=O)NCc2ccccc2C)cc1
InChIInChI=1S/C17H18N2O3/c1-12-5-3-4-6-13(12)11-18-16(20)17(21)19-14-7-9-15(22-2)10-8-14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyWSOQKHSSJITSKM-UHFFFAOYSA-N
XLogP2.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2-methylphenyl)methyl]-N'-phenyloxamide
CID 2174485
N'-(3,4-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 7585276
N-(4-methoxyphenyl)-2-(2-methylphenyl)acetamide
CID 6467093
N'-(3-chloro-4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 108984615
N'-(2-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 2223435
N-[(2-methylphenyl)methyl]-N'-[4-(4-methylpiperazin-1-yl)phenyl]oxamide
CID 108984636
N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide
CID 125145113
N'-(3-chlorophenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 2174354
1-[(2-chlorophenyl)methyl]-3-(4-methoxyphenyl)urea
CID 6469547
N-(4-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118070
2-(2-bromophenyl)-N-(4-methoxyphenyl)acetamide
CID 51057355
N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide
CID 44995875

Frequently Asked Questions

What is the IUPAC name of N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide?
The IUPAC name of N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide (CID 7292696) is N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide.
What is the SMILES notation for N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide?
The canonical SMILES for N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide is COc1ccc(NC(=O)C(=O)NCc2ccccc2C)cc1.
What is the InChIKey of N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide?
The InChIKey is WSOQKHSSJITSKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-5-3-4-6-13(12)11-18-16(20)17(21)19-14-7-9-15(22-2)10-8-14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide?
N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide has a molecular weight of 298.34 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide is sourced from PubChem (CID 7292696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).