N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide

C20H24N2O4 — CID 86827111

IUPACN'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide
SMILESCCOc1ccc(NC(=O)C(=O)NCc2ccc(COC)cc2)c(C)c1
InChIInChI=1S/C20H24N2O4/c1-4-26-17-9-10-18(14(2)11-17)22-20(24)19(23)21-12-15-5-7-16(8-6-15)13-25-3/h5-11H,4,12-13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyIZGVKOGLGFQJHP-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.80
Rot. Bonds7

About N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide

N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide (PubChem CID 86827111) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide.

Molecular Properties

Compound NameN'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide
PubChem CID86827111
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide
SMILESCCOc1ccc(NC(=O)C(=O)NCc2ccc(COC)cc2)c(C)c1
InChIInChI=1S/C20H24N2O4/c1-4-26-17-9-10-18(14(2)11-17)22-20(24)19(23)21-12-15-5-7-16(8-6-15)13-25-3/h5-11H,4,12-13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyIZGVKOGLGFQJHP-UHFFFAOYSA-N
XLogP2.80
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.80
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-ethoxy-2-methylphenyl)oxamide
CID 86827079
N,N'-bis[(4-ethoxyphenyl)methyl]oxamide
CID 125144939
N'-[4-(dimethylamino)-2-methylphenyl]-N-[(4-methoxyphenyl)methyl]oxamide
CID 71894836
1-[(4-ethoxyphenyl)methyl]-3-(4-iodo-2-methylphenyl)urea
CID 108884390
N'-(2-ethoxyphenyl)-N-[(4-methoxyphenyl)methyl]oxamide
CID 2273905
2-bromo-N-(4-ethoxy-2-methylphenyl)propanamide
CID 107904117
N-(4-ethoxy-2-methylphenyl)-2-methoxypropanamide
CID 47312187
N'-(2,5-dimethylphenyl)-N-[(4-methoxyphenyl)methyl]oxamide
CID 3114031
[4-[(4-ethoxy-2-methylanilino)methyl]phenyl]methanol
CID 110006558
N'-(4-ethoxyphenyl)-N-[(4-fluorophenyl)methyl]oxamide
CID 2202978
N-[[4-(methoxymethyl)phenyl]methyl]-N'-(3-methyl-1,2-thiazol-5-yl)oxamide
CID 99783059
2-amino-N-(4-ethoxy-2-methylphenyl)-5-methoxypentanamide
CID 81082492

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide?
The IUPAC name of N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide (CID 86827111) is N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide.
What is the SMILES notation for N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide?
The canonical SMILES for N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide is CCOc1ccc(NC(=O)C(=O)NCc2ccc(COC)cc2)c(C)c1.
What is the InChIKey of N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide?
The InChIKey is IZGVKOGLGFQJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-4-26-17-9-10-18(14(2)11-17)22-20(24)19(23)21-12-15-5-7-16(8-6-15)13-25-3/h5-11H,4,12-13H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide?
N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide has a molecular weight of 356.42 g/mol, XLogP of 2.80, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxy-2-methylphenyl)-N-[[4-(methoxymethyl)phenyl]methyl]oxamide is sourced from PubChem (CID 86827111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).