N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide

C22H29N3O2 — CID 1094956

IUPACN-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide
SMILESCOc1ccc(NC(=O)CN2CCN(c3c(C)cc(C)cc3C)CC2)cc1
InChIInChI=1S/C22H29N3O2/c1-16-13-17(2)22(18(3)14-16)25-11-9-24(10-12-25)15-21(26)23-19-5-7-20(27-4)8-6-19/h5-8,13-14H,9-12,15H2,1-4H3,(H,23,26)
InChIKeyQHNHBDOAEQSAPK-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.38
Rot. Bonds5

About N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide

N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide (PubChem CID 1094956) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide
PubChem CID1094956
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC NameN-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide
SMILESCOc1ccc(NC(=O)CN2CCN(c3c(C)cc(C)cc3C)CC2)cc1
InChIInChI=1S/C22H29N3O2/c1-16-13-17(2)22(18(3)14-16)25-11-9-24(10-12-25)15-21(26)23-19-5-7-20(27-4)8-6-19/h5-8,13-14H,9-12,15H2,1-4H3,(H,23,26)
InChIKeyQHNHBDOAEQSAPK-UHFFFAOYSA-N
XLogP3.38
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-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

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide (CID 1094956) is N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide is COc1ccc(NC(=O)CN2CCN(c3c(C)cc(C)cc3C)CC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide?
The InChIKey is QHNHBDOAEQSAPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-16-13-17(2)22(18(3)14-16)25-11-9-24(10-12-25)15-21(26)23-19-5-7-20(27-4)8-6-19/h5-8,13-14H,9-12,15H2,1-4H3,(H,23,26).
What are the key properties of N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide?
N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide has a molecular weight of 367.49 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 1094956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).