2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide

C21H25NO5 — CID 43024655

IUPAC2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide
SMILESCCOc1ccc(OCC)c(NC(=O)Cc2cc(C(C)=O)ccc2OC)c1
InChIInChI=1S/C21H25NO5/c1-5-26-17-8-10-20(27-6-2)18(13-17)22-21(24)12-16-11-15(14(3)23)7-9-19(16)25-4/h7-11,13H,5-6,12H2,1-4H3,(H,22,24)
InChIKeyOJNUWWHVUQSWPD-UHFFFAOYSA-N
MW371.43 g/mol
LogP3.88
Rot. Bonds9

About 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide

2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide (PubChem CID 43024655) has the molecular formula C21H25NO5 and a molecular weight of 371.43 g/mol. Its IUPAC name is 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide
PubChem CID43024655
Molecular FormulaC21H25NO5
Molecular Weight371.43 g/mol
Exact Mass371.17
IUPAC Name2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide
SMILESCCOc1ccc(OCC)c(NC(=O)Cc2cc(C(C)=O)ccc2OC)c1
InChIInChI=1S/C21H25NO5/c1-5-26-17-8-10-20(27-6-2)18(13-17)22-21(24)12-16-11-15(14(3)23)7-9-19(16)25-4/h7-11,13H,5-6,12H2,1-4H3,(H,22,24)
InChIKeyOJNUWWHVUQSWPD-UHFFFAOYSA-N
XLogP3.88
TPSA73.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.43
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dimethoxyphenyl)acetamide
CID 16557440
2-(5-acetyl-2-methoxyphenyl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide
CID 16557123
N-(2,5-diethoxyphenyl)-2-methoxyacetamide
CID 34737899
N-(2,5-diethoxyphenyl)-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 26686594
2-(2-chlorophenyl)-N-(2,5-diethoxyphenyl)acetamide
CID 26179955
N-(2,5-diethoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 26179952
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dichlorophenyl)acetamide
CID 30845420
2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide
CID 30843617
(2S,3S)-2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-3-methylpentanoic acid
CID 119194209
2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-3-methylpentanoic acid
CID 119211962
N-(2,5-diethoxyphenyl)-2-methylsulfanylacetamide
CID 33312505
4-(2,5-diethoxyanilino)-4-oxobutanoic acid
CID 1133656

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide?
The IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide (CID 43024655) is 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide.
What is the SMILES notation for 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide?
The canonical SMILES for 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide is CCOc1ccc(OCC)c(NC(=O)Cc2cc(C(C)=O)ccc2OC)c1.
What is the InChIKey of 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide?
The InChIKey is OJNUWWHVUQSWPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO5/c1-5-26-17-8-10-20(27-6-2)18(13-17)22-21(24)12-16-11-15(14(3)23)7-9-19(16)25-4/h7-11,13H,5-6,12H2,1-4H3,(H,22,24).
What are the key properties of 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide?
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide has a molecular weight of 371.43 g/mol, XLogP of 3.88, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2-methoxyphenyl)-N-(2,5-diethoxyphenyl)acetamide is sourced from PubChem (CID 43024655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).