2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide

C15H23N3O3 — CID 84556181

IUPAC2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide
SMILESCOc1ccc(CC(=O)NN2CCN(C)CC2)c(OC)c1
InChIInChI=1S/C15H23N3O3/c1-17-6-8-18(9-7-17)16-15(19)10-12-4-5-13(20-2)11-14(12)21-3/h4-5,11H,6-10H2,1-3H3,(H,16,19)
InChIKeyHOWMLDUJXWUPEB-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.52
Rot. Bonds5

About 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide

2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide (PubChem CID 84556181) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide
PubChem CID84556181
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide
SMILESCOc1ccc(CC(=O)NN2CCN(C)CC2)c(OC)c1
InChIInChI=1S/C15H23N3O3/c1-17-6-8-18(9-7-17)16-15(19)10-12-4-5-13(20-2)11-14(12)21-3/h4-5,11H,6-10H2,1-3H3,(H,16,19)
InChIKeyHOWMLDUJXWUPEB-UHFFFAOYSA-N
XLogP0.52
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,4-dimethoxyphenyl)-1-(4-methyl-1,4-diazepan-1-yl)ethanone
CID 39948329
1-[(2,4-dimethoxyphenyl)methyl]-4-methylpiperazine;oxalic acid
CID 171151305
2-(4-methoxyphenyl)sulfanyl-N-(4-methylpiperazin-1-yl)acetamide
CID 9205759
N-cyclopentyl-2-(2,4-dimethoxyphenyl)acetamide
CID 17474203
N-(cyanomethyl)-2-(2,4-dimethoxyphenyl)acetamide
CID 96660716
2-(2,4-dimethoxyphenyl)-N-(2-hydroxyethyl)acetamide
CID 43389932
2-(2,4-dimethoxyphenyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
CID 39959114
N-(2-amino-2-oxoethyl)-2-(2,4-dimethoxyphenyl)acetamide
CID 9297010
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-(2,4-dimethoxyphenyl)acetamide
CID 107845955
N-(2-acetamidoethyl)-2-(2,4-dimethoxyphenyl)acetamide
CID 30597310
2-(2,4-dimethoxyphenyl)-1-(4-ethylpiperazin-1-yl)ethanone
CID 51072972
2-(2,4-dimethoxyphenyl)-N-[(2R)-2-hydroxypropyl]acetamide
CID 83031383

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide (CID 84556181) is 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide is COc1ccc(CC(=O)NN2CCN(C)CC2)c(OC)c1.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide?
The InChIKey is HOWMLDUJXWUPEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-17-6-8-18(9-7-17)16-15(19)10-12-4-5-13(20-2)11-14(12)21-3/h4-5,11H,6-10H2,1-3H3,(H,16,19).
What are the key properties of 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide?
2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide has a molecular weight of 293.37 g/mol, XLogP of 0.52, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide is sourced from PubChem (CID 84556181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).