N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide

C19H22N2O4 — CID 121478721

IUPACN'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide
SMILESCOc1ccc(CCNC(=O)C(=O)Nc2ccc(OC)c(C)c2)cc1
InChIInChI=1S/C19H22N2O4/c1-13-12-15(6-9-17(13)25-3)21-19(23)18(22)20-11-10-14-4-7-16(24-2)8-5-14/h4-9,12H,10-11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyZHISWOZRPRBLKQ-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.31
Rot. Bonds6

About N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide

N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide (PubChem CID 121478721) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide.

Molecular Properties

Compound NameN'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide
PubChem CID121478721
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide
SMILESCOc1ccc(CCNC(=O)C(=O)Nc2ccc(OC)c(C)c2)cc1
InChIInChI=1S/C19H22N2O4/c1-13-12-15(6-9-17(13)25-3)21-19(23)18(22)20-11-10-14-4-7-16(24-2)8-5-14/h4-9,12H,10-11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyZHISWOZRPRBLKQ-UHFFFAOYSA-N
XLogP2.31
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.31
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-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide?
The IUPAC name of N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide (CID 121478721) is N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide.
What is the SMILES notation for N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide?
The canonical SMILES for N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide is COc1ccc(CCNC(=O)C(=O)Nc2ccc(OC)c(C)c2)cc1.
What is the InChIKey of N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide?
The InChIKey is ZHISWOZRPRBLKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13-12-15(6-9-17(13)25-3)21-19(23)18(22)20-11-10-14-4-7-16(24-2)8-5-14/h4-9,12H,10-11H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide?
N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide has a molecular weight of 342.40 g/mol, XLogP of 2.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-methoxy-3-methylphenyl)-N-[2-(4-methoxyphenyl)ethyl]oxamide is sourced from PubChem (CID 121478721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).