N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide

C18H20N2O4 — CID 2271251

IUPACN-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
SMILESCCOc1ccc(NC(=O)C(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C18H20N2O4/c1-4-24-14-8-6-13(7-9-14)19-17(21)18(22)20-15-11-12(2)5-10-16(15)23-3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyZAAUPHOCRMQYTP-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.98
Rot. Bonds5

About N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide

N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide (PubChem CID 2271251) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
PubChem CID2271251
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
SMILESCCOc1ccc(NC(=O)C(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C18H20N2O4/c1-4-24-14-8-6-13(7-9-14)19-17(21)18(22)20-15-11-12(2)5-10-16(15)23-3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22)
InChIKeyZAAUPHOCRMQYTP-UHFFFAOYSA-N
XLogP2.98
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
The IUPAC name of N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide (CID 2271251) is N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
The canonical SMILES for N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide is CCOc1ccc(NC(=O)C(=O)Nc2cc(C)ccc2OC)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
The InChIKey is ZAAUPHOCRMQYTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-4-24-14-8-6-13(7-9-14)19-17(21)18(22)20-15-11-12(2)5-10-16(15)23-3/h5-11H,4H2,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide has a molecular weight of 328.37 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide is sourced from PubChem (CID 2271251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).