N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide

C20H23N3O5 — CID 113174784

IUPACN-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide
SMILESCOc1ccc(N(CC(=O)Nc2ccc(NC(C)=O)cc2)C(C)=O)c(OC)c1
InChIInChI=1S/C20H23N3O5/c1-13(24)21-15-5-7-16(8-6-15)22-20(26)12-23(14(2)25)18-10-9-17(27-3)11-19(18)28-4/h5-11H,12H2,1-4H3,(H,21,24)(H,22,26)
InChIKeyXJYIVAYOMCDVHH-UHFFFAOYSA-N
MW385.42 g/mol
LogP2.65
Rot. Bonds7

About N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide

N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide (PubChem CID 113174784) has the molecular formula C20H23N3O5 and a molecular weight of 385.42 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide
PubChem CID113174784
Molecular FormulaC20H23N3O5
Molecular Weight385.42 g/mol
Exact Mass385.16
IUPAC NameN-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide
SMILESCOc1ccc(N(CC(=O)Nc2ccc(NC(C)=O)cc2)C(C)=O)c(OC)c1
InChIInChI=1S/C20H23N3O5/c1-13(24)21-15-5-7-16(8-6-15)22-20(26)12-23(14(2)25)18-10-9-17(27-3)11-19(18)28-4/h5-11H,12H2,1-4H3,(H,21,24)(H,22,26)
InChIKeyXJYIVAYOMCDVHH-UHFFFAOYSA-N
XLogP2.65
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.42
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(N-acetyl-2,4-dimethoxyanilino)-N-(4-methylphenyl)acetamide
CID 113174733
2-(N-acetyl-2,4-dimethoxyanilino)-N-(2,3,4-trifluorophenyl)acetamide
CID 113174807
2-(N-acetyl-2,4-dimethoxyanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 113174773
2-(N-acetyl-2,5-dimethoxyanilino)-N-(3-fluorophenyl)acetamide
CID 113174637
N-(4-bromophenyl)-2-(2,4-dimethoxy-N-methylsulfonylanilino)acetamide
CID 998604
N-(4-acetamidophenyl)-2-(N-acetyl-2-ethoxyanilino)acetamide
CID 113173812
N-(2,4-dimethoxyphenyl)-N-[2-(phenylcarbamoylamino)ethyl]acetamide
CID 113061264
2-(N-acetyl-5-chloro-2-methoxyanilino)-N-(4-propan-2-yloxyphenyl)acetamide
CID 113172889
2-[N-acetyl-4-(dimethylamino)anilino]-N-(4-methoxyphenyl)acetamide
CID 113176766
2-(N-acetyl-2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)acetamide
CID 113174587
3-(N-acetyl-2,4-dimethoxyanilino)-N-prop-2-enylpropanamide
CID 113130062
2-(N-acetyl-2-methoxy-5-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 113174146

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide (CID 113174784) is N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide is COc1ccc(N(CC(=O)Nc2ccc(NC(C)=O)cc2)C(C)=O)c(OC)c1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide?
The InChIKey is XJYIVAYOMCDVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O5/c1-13(24)21-15-5-7-16(8-6-15)22-20(26)12-23(14(2)25)18-10-9-17(27-3)11-19(18)28-4/h5-11H,12H2,1-4H3,(H,21,24)(H,22,26).
What are the key properties of N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide?
N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide has a molecular weight of 385.42 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(N-acetyl-2,4-dimethoxyanilino)acetamide is sourced from PubChem (CID 113174784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).