N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide

C18H20N2O3 — CID 108952937

IUPACN'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide
SMILESCCOc1ccccc1NC(=O)CC(=O)Nc1ccccc1C
InChIInChI=1S/C18H20N2O3/c1-3-23-16-11-7-6-10-15(16)20-18(22)12-17(21)19-14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeySBVNKTQAFZAXEX-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.36
Rot. Bonds6

About N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide

N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide (PubChem CID 108952937) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide.

Molecular Properties

Compound NameN'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide
PubChem CID108952937
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide
SMILESCCOc1ccccc1NC(=O)CC(=O)Nc1ccccc1C
InChIInChI=1S/C18H20N2O3/c1-3-23-16-11-7-6-10-15(16)20-18(22)12-17(21)19-14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeySBVNKTQAFZAXEX-UHFFFAOYSA-N
XLogP3.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N-(4-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955185
methyl 3-(2-ethoxyanilino)-3-oxopropanoate
CID 28637956
2-(2,6-dimethylphenoxy)-N-(2-ethoxyphenyl)acetamide
CID 834898
N-(3-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955086
CID 174193763
CID 174193763
N-(2-ethoxyphenyl)-2-(2-hydroxyethylamino)acetamide
CID 82358452
6-N-(2-ethoxyphenyl)-2-N-(2-methylphenyl)pyridine-2,6-dicarboxamide
CID 109100070
N-[2-(2-ethoxyanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112998801
N-(2-cyanophenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955712
N-benzyl-N'-(2-ethoxyphenyl)propanediamide
CID 108945295
N-(4-acetylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955673
N-(2-ethoxyphenyl)-2-(5-fluoro-2-methylanilino)acetamide
CID 2516932

Frequently Asked Questions

What is the IUPAC name of N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide?
The IUPAC name of N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide (CID 108952937) is N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide.
What is the SMILES notation for N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide?
The canonical SMILES for N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide is CCOc1ccccc1NC(=O)CC(=O)Nc1ccccc1C.
What is the InChIKey of N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide?
The InChIKey is SBVNKTQAFZAXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-3-23-16-11-7-6-10-15(16)20-18(22)12-17(21)19-14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide?
N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide has a molecular weight of 312.37 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-ethoxyphenyl)-N-(2-methylphenyl)propanediamide is sourced from PubChem (CID 108952937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).