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

C19H22N2O4 — CID 108518165

IUPACN-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide
SMILESCOc1ccc(OCCNC(=O)C(=O)NCc2ccc(C)cc2)cc1
InChIInChI=1S/C19H22N2O4/c1-14-3-5-15(6-4-14)13-21-19(23)18(22)20-11-12-25-17-9-7-16(24-2)8-10-17/h3-10H,11-13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyUNQZIAGIIOKUFA-UHFFFAOYSA-N
MW342.40 g/mol
LogP1.82
Rot. Bonds7

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

N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide (PubChem CID 108518165) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide
PubChem CID108518165
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide
SMILESCOc1ccc(OCCNC(=O)C(=O)NCc2ccc(C)cc2)cc1
InChIInChI=1S/C19H22N2O4/c1-14-3-5-15(6-4-14)13-21-19(23)18(22)20-11-12-25-17-9-7-16(24-2)8-10-17/h3-10H,11-13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyUNQZIAGIIOKUFA-UHFFFAOYSA-N
XLogP1.82
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 ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(4-methoxyphenoxy)ethylamino]-N-[(4-methylphenyl)methyl]acetamide
CID 108997186
1-[2-(4-methoxyphenyl)ethyl]-3-[2-(4-methylphenoxy)ethyl]urea
CID 112970038
N-(3-chloropropyl)-N'-[(4-methoxyphenyl)methyl]oxamide
CID 108508151
N-(3-ethoxypropyl)-N'-[(4-methoxyphenyl)methyl]oxamide
CID 21369943
2-[2-(4-methoxyphenoxy)ethylamino]-N-[(4-methylphenyl)methyl]pyrimidine-5-carboxamide
CID 109256110
N,N'-bis[(4-methylphenyl)methyl]oxamide
CID 3116969
N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide
CID 40724453
1-[2-(4-methoxyphenoxy)ethyl]-3-(4-methylphenyl)urea
CID 51244378
N'-(4-butoxyphenyl)-N-[(4-methoxyphenyl)methyl]oxamide
CID 2194197
N'-[1-(4-methoxyphenyl)ethyl]-N-[(4-methylphenyl)methyl]oxamide
CID 108510275
1-[2-(3,4-dimethylphenoxy)ethyl]-3-[(4-methoxyphenyl)methyl]urea
CID 112974093
N'-(2,5-dimethylphenyl)-N-[(4-methoxyphenyl)methyl]oxamide
CID 3114031

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide (CID 108518165) is N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide is COc1ccc(OCCNC(=O)C(=O)NCc2ccc(C)cc2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide?
The InChIKey is UNQZIAGIIOKUFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-14-3-5-15(6-4-14)13-21-19(23)18(22)20-11-12-25-17-9-7-16(24-2)8-10-17/h3-10H,11-13H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide?
N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide has a molecular weight of 342.40 g/mol, XLogP of 1.82, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenoxy)ethyl]-N'-[(4-methylphenyl)methyl]oxamide is sourced from PubChem (CID 108518165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).