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

C19H22N2O4 — CID 125145113

IUPACN-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide
SMILESCCCOc1ccc(NC(=O)C(=O)NCc2ccccc2OC)cc1
InChIInChI=1S/C19H22N2O4/c1-3-12-25-16-10-8-15(9-11-16)21-19(23)18(22)20-13-14-6-4-5-7-17(14)24-2/h4-11H,3,12-13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyVCRODMQGTGDTPT-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.74
Rot. Bonds7

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

N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide (PubChem CID 125145113) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide
PubChem CID125145113
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide
SMILESCCCOc1ccc(NC(=O)C(=O)NCc2ccccc2OC)cc1
InChIInChI=1S/C19H22N2O4/c1-3-12-25-16-10-8-15(9-11-16)21-19(23)18(22)20-13-14-6-4-5-7-17(14)24-2/h4-11H,3,12-13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyVCRODMQGTGDTPT-UHFFFAOYSA-N
XLogP2.74
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-N'-(4-propoxyphenyl)oxamide
CID 124624786
N-[(2-methoxyphenyl)methyl]-N'-(4-propan-2-ylphenyl)oxamide
CID 2175728
N-ethyl-N'-(4-propoxyphenyl)oxamide
CID 124624762
N'-(3,5-dimethylphenyl)-N-[(2-methoxyphenyl)methyl]oxamide
CID 7541451
N'-(4-butoxyphenyl)-N-[(4-methoxyphenyl)methyl]oxamide
CID 2194197
N'-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]oxamide
CID 7292696
N-[(2-methoxyphenyl)methyl]-N'-[4-(4-methylpiperazin-1-yl)phenyl]oxamide
CID 108527615
N-(2-hydroxyethyl)-N'-(4-propoxyphenyl)oxamide
CID 124624780
N'-(4-ethoxyphenyl)-N-[(2-fluorophenyl)methyl]oxamide
CID 2989314
N-(2-phenylethyl)-N'-(4-propoxyphenyl)oxamide
CID 2966854
N'-(4-bromo-3-methylphenyl)-N-[(2-methoxyphenyl)methyl]oxamide
CID 108531641
N-pentyl-N'-(4-propoxyphenyl)oxamide
CID 124624768

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide (CID 125145113) is N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide is CCCOc1ccc(NC(=O)C(=O)NCc2ccccc2OC)cc1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide?
The InChIKey is VCRODMQGTGDTPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-3-12-25-16-10-8-15(9-11-16)21-19(23)18(22)20-13-14-6-4-5-7-17(14)24-2/h4-11H,3,12-13H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide?
N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide has a molecular weight of 342.40 g/mol, XLogP of 2.74, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N'-(4-propoxyphenyl)oxamide is sourced from PubChem (CID 125145113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).