2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide

C21H24N2O4 — CID 17427408

IUPAC2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)NCC(=O)Nc1cccc(C)c1C
InChIInChI=1S/C21H24N2O4/c1-13-6-5-7-18(14(13)2)23-21(26)12-22-20(25)11-17-10-16(15(3)24)8-9-19(17)27-4/h5-10H,11-12H2,1-4H3,(H,22,25)(H,23,26)
InChIKeyQKXBZOYOKJHLGH-UHFFFAOYSA-N
MW368.43 g/mol
LogP2.81
Rot. Bonds7

About 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide

2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide (PubChem CID 17427408) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide
PubChem CID17427408
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC Name2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)NCC(=O)Nc1cccc(C)c1C
InChIInChI=1S/C21H24N2O4/c1-13-6-5-7-18(14(13)2)23-21(26)12-22-20(25)11-17-10-16(15(3)24)8-9-19(17)27-4/h5-10H,11-12H2,1-4H3,(H,22,25)(H,23,26)
InChIKeyQKXBZOYOKJHLGH-UHFFFAOYSA-N
XLogP2.81
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-acetyl-2-methoxyphenyl)-N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]acetamide
CID 30867221
3-(3,4-dimethoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]propanamide
CID 26660572
[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl] 3-ethoxy-4-methoxybenzoate
CID 7558697
2-(5-acetyl-2-methoxyphenyl)-N-(5-chloro-2-methylphenyl)acetamide
CID 30843617
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-4-(2-methoxy-5-methylphenyl)-4-oxobutanamide
CID 18112877
2-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
CID 34729772
2-[[2-[(3,4-dimethoxyphenyl)methyl-methylamino]acetyl]amino]-N-(2,3-dimethylphenyl)acetamide
CID 9058226
[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl] 2-(3,4-dimethoxyphenyl)acetate
CID 7968949
methyl 3-[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]benzoate
CID 17410752
2-(5-acetyl-2-methoxyphenyl)-N-(2,5-dimethoxyphenyl)acetamide
CID 16557440
2-[(2-bromoacetyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 55246569
(4,5-dimethoxy-2-methylphenyl)methyl-[2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]-methylazanium
CID 8551992

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide (CID 17427408) is 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide is COc1ccc(C(C)=O)cc1CC(=O)NCC(=O)Nc1cccc(C)c1C.
What is the InChIKey of 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide?
The InChIKey is QKXBZOYOKJHLGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O4/c1-13-6-5-7-18(14(13)2)23-21(26)12-22-20(25)11-17-10-16(15(3)24)8-9-19(17)27-4/h5-10H,11-12H2,1-4H3,(H,22,25)(H,23,26).
What are the key properties of 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide?
2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide has a molecular weight of 368.43 g/mol, XLogP of 2.81, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2-methoxyphenyl)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 17427408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).