2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide

C19H22N2O4 — CID 2481404

IUPAC2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
SMILESCCOc1ccccc1C(=O)N(C)CC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C19H22N2O4/c1-4-25-17-8-6-5-7-16(17)19(23)21(2)13-18(22)20-14-9-11-15(24-3)12-10-14/h5-12H,4,13H2,1-3H3,(H,20,22)
InChIKeyYHSWABYBZPTWGE-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.80
Rot. Bonds7

About 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide

2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide (PubChem CID 2481404) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
PubChem CID2481404
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
SMILESCCOc1ccccc1C(=O)N(C)CC(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C19H22N2O4/c1-4-25-17-8-6-5-7-16(17)19(23)21(2)13-18(22)20-14-9-11-15(24-3)12-10-14/h5-12H,4,13H2,1-3H3,(H,20,22)
InChIKeyYHSWABYBZPTWGE-UHFFFAOYSA-N
XLogP2.80
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 39122596
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
2-(difluoromethylsulfanyl)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 18189532
2-ethoxy-N-methyl-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]benzamide
CID 27786720
2-bromo-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methylbenzamide
CID 2475779
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(4-methoxyphenyl)acetamide
CID 7719333
2-[(4-methoxybenzoyl)amino]-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 38008073
2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide
CID 18116979
2-(2-ethoxyanilino)-N-(4-methoxyphenyl)acetamide
CID 26438880
4-ethoxy-N-[2-[[2-(4-methoxyanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]benzamide
CID 9438552
N-[(2,4-dimethoxyphenyl)methyl]-2-ethoxy-N-methylbenzamide
CID 18111735
N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N,2,3-trimethylbenzamide
CID 43010376

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide?
The IUPAC name of 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide (CID 2481404) is 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide.
What is the SMILES notation for 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide?
The canonical SMILES for 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide is CCOc1ccccc1C(=O)N(C)CC(=O)Nc1ccc(OC)cc1.
What is the InChIKey of 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide?
The InChIKey is YHSWABYBZPTWGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-4-25-17-8-6-5-7-16(17)19(23)21(2)13-18(22)20-14-9-11-15(24-3)12-10-14/h5-12H,4,13H2,1-3H3,(H,20,22).
What are the key properties of 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide?
2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide has a molecular weight of 342.40 g/mol, XLogP of 2.80, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylbenzamide is sourced from PubChem (CID 2481404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).