2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide

C25H26N2O4 — CID 55380656

IUPAC2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide
SMILESCCOc1ccccc1CCC(=O)Nc1ccccc1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C25H26N2O4/c1-3-31-23-14-7-4-9-18(23)15-16-24(28)27-22-13-6-5-12-21(22)25(29)26-19-10-8-11-20(17-19)30-2/h4-14,17H,3,15-16H2,1-2H3,(H,26,29)(H,27,28)
InChIKeyPJKZCAJFGNCLBF-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.92
Rot. Bonds9

About 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide

2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide (PubChem CID 55380656) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide
PubChem CID55380656
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC Name2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide
SMILESCCOc1ccccc1CCC(=O)Nc1ccccc1C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C25H26N2O4/c1-3-31-23-14-7-4-9-18(23)15-16-24(28)27-22-13-6-5-12-21(22)25(29)26-19-10-8-11-20(17-19)30-2/h4-14,17H,3,15-16H2,1-2H3,(H,26,29)(H,27,28)
InChIKeyPJKZCAJFGNCLBF-UHFFFAOYSA-N
XLogP4.92
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.49
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
N-(3-methoxyphenyl)-2-[3-(3-methylphenyl)propanoylamino]benzamide
CID 55456678
2-[[2-(2-fluorophenyl)acetyl]amino]-N-(3-methoxyphenyl)benzamide
CID 2516706
2-[[2-(4-chlorophenyl)acetyl]amino]-N-(3-methoxyphenyl)benzamide
CID 29263476
N-(3-methoxyphenyl)-2-[[4-(4-methylphenyl)-4-oxobutanoyl]amino]benzamide
CID 55342717
N-[3-[2-[(3-methoxyphenyl)carbamoyl]anilino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55577306
N-(3-methoxyphenyl)-2-[(2-thiophen-3-ylacetyl)amino]benzamide
CID 4787980
2-[[4-(4-chlorophenyl)-4-oxobutanoyl]amino]-N-(3-methoxyphenyl)benzamide
CID 55343011
N-(2,5-diethoxyphenyl)-3-(2-ethoxyphenyl)propanamide
CID 33002086
2-[[2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]acetyl]amino]-N-phenylbenzamide
CID 2521413
2-[[2-(2-ethoxyanilino)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 30568013
N-[3-[3-(2-ethoxyphenyl)propanoylamino]phenyl]furan-2-carboxamide
CID 32708292

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide (CID 55380656) is 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide is CCOc1ccccc1CCC(=O)Nc1ccccc1C(=O)Nc1cccc(OC)c1.
What is the InChIKey of 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide?
The InChIKey is PJKZCAJFGNCLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-3-31-23-14-7-4-9-18(23)15-16-24(28)27-22-13-6-5-12-21(22)25(29)26-19-10-8-11-20(17-19)30-2/h4-14,17H,3,15-16H2,1-2H3,(H,26,29)(H,27,28).
What are the key properties of 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide?
2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide has a molecular weight of 418.49 g/mol, XLogP of 4.92, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-ethoxyphenyl)propanoylamino]-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 55380656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).