2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide

C20H25N3O2 — CID 3160208

IUPAC2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccccc2N2CCN(C)CC2)cc1
InChIInChI=1S/C20H25N3O2/c1-16-7-9-17(10-8-16)25-15-20(24)21-18-5-3-4-6-19(18)23-13-11-22(2)12-14-23/h3-10H,11-15H2,1-2H3,(H,21,24)
InChIKeyWWVZWKLVKPXGTM-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.76
Rot. Bonds5

About 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide

2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide (PubChem CID 3160208) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
PubChem CID3160208
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
SMILESCc1ccc(OCC(=O)Nc2ccccc2N2CCN(C)CC2)cc1
InChIInChI=1S/C20H25N3O2/c1-16-7-9-17(10-8-16)25-15-20(24)21-18-5-3-4-6-19(18)23-13-11-22(2)12-14-23/h3-10H,11-15H2,1-2H3,(H,21,24)
InChIKeyWWVZWKLVKPXGTM-UHFFFAOYSA-N
XLogP2.76
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]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

N-[2-(4-methylpiperazin-1-yl)phenyl]-2-(4-phenoxyphenoxy)acetamide
CID 43039942
2-(4-bromophenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 1263245
2-(4-methylphenoxy)-N-[2-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl]acetamide
CID 1017654
2-(4-methylphenoxy)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]acetamide
CID 4503314
2-(2-cyanophenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 18189900
2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]acetamide
CID 122299107
2-(4-propanoylphenoxy)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 2714751
2-(4-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 836156
2-(4-chlorophenoxy)-N-(2-morpholin-4-ylphenyl)acetamide
CID 1078563
N-[2-(azepan-1-yl)phenyl]-2-(4-formylphenoxy)acetamide
CID 78878320
N-[4,6-dimethyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]-2-(4-methylphenoxy)acetamide
CID 122357173
4-(4-methylphenoxy)-N-(2-morpholin-4-ylphenyl)butanamide
CID 7922267

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide (CID 3160208) is 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide is Cc1ccc(OCC(=O)Nc2ccccc2N2CCN(C)CC2)cc1.
What is the InChIKey of 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
The InChIKey is WWVZWKLVKPXGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-16-7-9-17(10-8-16)25-15-20(24)21-18-5-3-4-6-19(18)23-13-11-22(2)12-14-23/h3-10H,11-15H2,1-2H3,(H,21,24).
What are the key properties of 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide?
2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide has a molecular weight of 339.44 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenoxy)-N-[2-(4-methylpiperazin-1-yl)phenyl]acetamide is sourced from PubChem (CID 3160208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).