N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide

C17H18N2O3 — CID 44995875

IUPACN'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide
SMILESCOc1ccc(NC(=O)C(=O)Nc2cccc(C)c2C)cc1
InChIInChI=1S/C17H18N2O3/c1-11-5-4-6-15(12(11)2)19-17(21)16(20)18-13-7-9-14(22-3)10-8-13/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyMFCHMQACZJQBAM-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.89
Rot. Bonds3

About N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide

N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide (PubChem CID 44995875) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide.

Molecular Properties

Compound NameN'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide
PubChem CID44995875
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide
SMILESCOc1ccc(NC(=O)C(=O)Nc2cccc(C)c2C)cc1
InChIInChI=1S/C17H18N2O3/c1-11-5-4-6-15(12(11)2)19-17(21)16(20)18-13-7-9-14(22-3)10-8-13/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyMFCHMQACZJQBAM-UHFFFAOYSA-N
XLogP2.89
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.89
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-(2,3-dimethylphenyl)-N'-[(4-methoxyphenyl)methylideneamino]oxamide
CID 4620336
N-(2,3-dimethylphenyl)-3-(4-methoxyanilino)propanamide
CID 109035957
[4-[[2-(2,3-dimethylanilino)-2-oxoacetyl]amino]phenyl] thiocyanate
CID 108515336
N-(2,3-dimethylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 2789567
1-(2,3-dimethylphenyl)-3-(4-methoxy-2-methylphenyl)urea
CID 46860194
N'-(2,3-dimethylphenyl)-N-(4-pyrrolidin-1-ylphenyl)oxamide
CID 108986873
N-(2,3-dimethylphenyl)-3-(4-methoxyphenyl)prop-2-enamide
CID 668253
N,N'-bis[4-(4-methoxy-N-(4-methoxyphenyl)anilino)phenyl]oxamide
CID 134218618
N'-(4-bromo-2-methylphenyl)-N-(4-methoxyphenyl)oxamide
CID 108502691
N-(2,3-dimethylphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 44996651
4-[(2,3-dimethylphenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
CID 9411974
(Z)-2-cyano-3-[4-[2-(2,3-dimethylanilino)-2-oxoethoxy]phenyl]-N-(4-methoxyphenyl)prop-2-enamide
CID 126256634

Frequently Asked Questions

What is the IUPAC name of N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide?
The IUPAC name of N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide (CID 44995875) is N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide.
What is the SMILES notation for N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide?
The canonical SMILES for N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide is COc1ccc(NC(=O)C(=O)Nc2cccc(C)c2C)cc1.
What is the InChIKey of N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide?
The InChIKey is MFCHMQACZJQBAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-11-5-4-6-15(12(11)2)19-17(21)16(20)18-13-7-9-14(22-3)10-8-13/h4-10H,1-3H3,(H,18,20)(H,19,21).
What are the key properties of N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide?
N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide has a molecular weight of 298.34 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,3-dimethylphenyl)-N-(4-methoxyphenyl)oxamide is sourced from PubChem (CID 44995875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).