4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide

C17H24N4O3 — CID 8904118

IUPAC4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide
SMILESCC(=O)N1CCN(CC(=O)Nc2ccc(C(=O)N(C)C)cc2)CC1
InChIInChI=1S/C17H24N4O3/c1-13(22)21-10-8-20(9-11-21)12-16(23)18-15-6-4-14(5-7-15)17(24)19(2)3/h4-7H,8-12H2,1-3H3,(H,18,23)
InChIKeyYVUJLSZOXJEIOA-UHFFFAOYSA-N
MW332.40 g/mol
LogP0.49
Rot. Bonds4

About 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide

4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide (PubChem CID 8904118) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide
PubChem CID8904118
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC Name4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide
SMILESCC(=O)N1CCN(CC(=O)Nc2ccc(C(=O)N(C)C)cc2)CC1
InChIInChI=1S/C17H24N4O3/c1-13(22)21-10-8-20(9-11-21)12-16(23)18-15-6-4-14(5-7-15)17(24)19(2)3/h4-7H,8-12H2,1-3H3,(H,18,23)
InChIKeyYVUJLSZOXJEIOA-UHFFFAOYSA-N
XLogP0.49
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-acetylpiperazin-1-yl)-N-(4-methylphenyl)acetamide
CID 2697560
4-[[2-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)acetyl]amino]-N,N-dimethylbenzamide
CID 46802394
4-[[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 8582749
4-[[2-[4-[(4-chlorophenyl)methyl]-1,4-diazepan-1-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 30668935
2-(4-acetylpiperazin-1-yl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
CID 8904009
4-[[2-(2,6-dimethylmorpholin-4-yl)acetyl]amino]-N,N-dimethylbenzamide
CID 51170483
ethyl 1-[2-[4-(dimethylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxylate
CID 8931262
N,N'-bis[4-(dimethylcarbamoyl)phenyl]propanediamide
CID 17368155
butyl 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]benzoate
CID 8904442
ethyl 4-[2-(4-acetylanilino)-2-oxoethyl]piperazine-1-carboxylate
CID 8932201
4-[[2-(4-amino-3,3-dimethylpiperidin-1-yl)acetyl]amino]-N,N-dimethylbenzamide;hydrochloride
CID 120775335
N,N-dimethyl-4-[[2-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]acetyl]amino]benzamide
CID 39948967

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide?
The IUPAC name of 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide (CID 8904118) is 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide?
The canonical SMILES for 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide is CC(=O)N1CCN(CC(=O)Nc2ccc(C(=O)N(C)C)cc2)CC1.
What is the InChIKey of 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide?
The InChIKey is YVUJLSZOXJEIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-13(22)21-10-8-20(9-11-21)12-16(23)18-15-6-4-14(5-7-15)17(24)19(2)3/h4-7H,8-12H2,1-3H3,(H,18,23).
What are the key properties of 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide?
4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide has a molecular weight of 332.40 g/mol, XLogP of 0.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-acetylpiperazin-1-yl)acetyl]amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 8904118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).