2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide

C23H28N2O4 — CID 30867500

IUPAC2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)N(C)CC(=O)Nc1c(C)cc(C)cc1C
InChIInChI=1S/C23H28N2O4/c1-14-9-15(2)23(16(3)10-14)24-21(27)13-25(5)22(28)12-19-11-18(17(4)26)7-8-20(19)29-6/h7-11H,12-13H2,1-6H3,(H,24,27)
InChIKeyVYODSIDQPRBILX-UHFFFAOYSA-N
MW396.49 g/mol
LogP3.46
Rot. Bonds7

About 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide

2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide (PubChem CID 30867500) has the molecular formula C23H28N2O4 and a molecular weight of 396.49 g/mol. Its IUPAC name is 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
PubChem CID30867500
Molecular FormulaC23H28N2O4
Molecular Weight396.49 g/mol
Exact Mass396.20
IUPAC Name2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
SMILESCOc1ccc(C(C)=O)cc1CC(=O)N(C)CC(=O)Nc1c(C)cc(C)cc1C
InChIInChI=1S/C23H28N2O4/c1-14-9-15(2)23(16(3)10-14)24-21(27)13-25(5)22(28)12-19-11-18(17(4)26)7-8-20(19)29-6/h7-11H,12-13H2,1-6H3,(H,24,27)
InChIKeyVYODSIDQPRBILX-UHFFFAOYSA-N
XLogP3.46
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide with MolForge

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Related Compounds

3,4-dimethoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 7974245
2-(5-acetyl-2-methoxyphenyl)-N,N-dimethylacetamide
CID 78792072
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 8752660
2-methoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 27783988
N-methyl-2-naphthalen-1-yl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 8752580
2-(5-acetyl-2-methoxyphenyl)-N-butan-2-yl-N-methylacetamide
CID 134006092
2-(5-acetyl-2-methoxyphenyl)-N-[(5-bromo-2-methoxyphenyl)methyl]-N-methylacetamide
CID 31152699
2-amino-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide
CID 119291379
methyl N-[2-[methyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]amino]-2-oxoethyl]carbamate
CID 75415569
2-(5-acetyl-2-methoxyphenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 78803448
2-(N-acetyl-3,4-dimethoxyanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 113174903
3-(3,5-dimethoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]propanamide
CID 9093129

Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide?
The IUPAC name of 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide (CID 30867500) is 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide.
What is the SMILES notation for 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide?
The canonical SMILES for 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide is COc1ccc(C(C)=O)cc1CC(=O)N(C)CC(=O)Nc1c(C)cc(C)cc1C.
What is the InChIKey of 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide?
The InChIKey is VYODSIDQPRBILX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O4/c1-14-9-15(2)23(16(3)10-14)24-21(27)13-25(5)22(28)12-19-11-18(17(4)26)7-8-20(19)29-6/h7-11H,12-13H2,1-6H3,(H,24,27).
What are the key properties of 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide?
2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide has a molecular weight of 396.49 g/mol, XLogP of 3.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyl-2-methoxyphenyl)-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]acetamide is sourced from PubChem (CID 30867500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).