N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide

C16H25N3O — CID 22273392

IUPACN-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
SMILESCc1cccc(C)c1NC(=O)CN1CC(C)NC(C)C1
InChIInChI=1S/C16H25N3O/c1-11-6-5-7-12(2)16(11)18-15(20)10-19-8-13(3)17-14(4)9-19/h5-7,13-14,17H,8-10H2,1-4H3,(H,18,20)
InChIKeyCQPLVULZIDAGMZ-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.92
Rot. Bonds3

About N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide

N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide (PubChem CID 22273392) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
PubChem CID22273392
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide
SMILESCc1cccc(C)c1NC(=O)CN1CC(C)NC(C)C1
InChIInChI=1S/C16H25N3O/c1-11-6-5-7-12(2)16(11)18-15(20)10-19-8-13(3)17-14(4)9-19/h5-7,13-14,17H,8-10H2,1-4H3,(H,18,20)
InChIKeyCQPLVULZIDAGMZ-UHFFFAOYSA-N
XLogP1.92
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide 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-(3,5-dimethylpiperazin-1-yl)-N-(4-methylphenyl)acetamide
CID 63874471
N-(2-amino-6-methylphenyl)-2-(3,5-dimethylpiperidin-1-yl)acetamide
CID 43375658
N-(2-ethyl-6-methylphenyl)-2-(3-hydroxyazetidin-1-yl)acetamide
CID 63282563
N-(5-chloro-2-methylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide;hydrochloride
CID 119923981
2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 8930637
2-[4-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
CID 8917312
1-[2-(2,6-dimethylanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 800463
2-(1,4-diazepan-1-yl)-N-(2,6-dimethylphenyl)acetamide
CID 43162514
2-(3,5-dimethylpiperazin-1-yl)-N-(3-methyl-1,2-oxazol-5-yl)acetamide;hydrochloride
CID 119924199
2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-(2-methyl-6-nitrophenyl)acetamide
CID 8930876
2-[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-N-(2,6-dimethylphenyl)acetamide
CID 120760035
N-(2,6-dimethylphenyl)-2-[4-[2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl]piperazin-1-yl]acetamide
CID 8744383

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide (CID 22273392) is N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide is Cc1cccc(C)c1NC(=O)CN1CC(C)NC(C)C1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
The InChIKey is CQPLVULZIDAGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-11-6-5-7-12(2)16(11)18-15(20)10-19-8-13(3)17-14(4)9-19/h5-7,13-14,17H,8-10H2,1-4H3,(H,18,20).
What are the key properties of N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide?
N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide has a molecular weight of 275.40 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-(3,5-dimethylpiperazin-1-yl)acetamide is sourced from PubChem (CID 22273392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).