2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone

C20H24N2O2 — CID 8910906

IUPAC2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
SMILESCOc1ccc(CC(=O)N2CCN(c3ccccc3C)CC2)cc1
InChIInChI=1S/C20H24N2O2/c1-16-5-3-4-6-19(16)21-11-13-22(14-12-21)20(23)15-17-7-9-18(24-2)10-8-17/h3-10H,11-15H2,1-2H3
InChIKeyAEEGFGJZQRYZKD-UHFFFAOYSA-N
MW324.42 g/mol
LogP2.89
Rot. Bonds4

About 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone

2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone (PubChem CID 8910906) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
PubChem CID8910906
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
SMILESCOc1ccc(CC(=O)N2CCN(c3ccccc3C)CC2)cc1
InChIInChI=1S/C20H24N2O2/c1-16-5-3-4-6-19(16)21-11-13-22(14-12-21)20(23)15-17-7-9-18(24-2)10-8-17/h3-10H,11-15H2,1-2H3
InChIKeyAEEGFGJZQRYZKD-UHFFFAOYSA-N
XLogP2.89
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone
CID 9153668
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 92672754
2-(4-methoxyphenyl)-1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]ethanone
CID 110398838
2-(4-methoxyphenyl)-1-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]ethanone
CID 113076293
(E)-1-hydroxy-4-[2-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]phenyl]but-3-en-2-one
CID 160699602
1-[4-(2,4-dichlorophenyl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 113080214
1-[(4-methoxyphenyl)methyl]-4-(2-methylphenyl)piperazine
CID 791315
N-(4-methoxyphenyl)-4-(2-methylphenyl)piperazine-1-carboxamide
CID 30938006
1-[4-(2,4-difluorophenyl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 113079882
2-(4-methoxyphenyl)-1-(4-methylpiperazin-1-yl)ethanone;hydrochloride
CID 17387901
2-(4-methoxyphenyl)-1-[4-(4-piperidin-1-ylphenyl)piperazin-1-yl]ethanone
CID 113078995
[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl] 2-(4-methoxyphenyl)acetate
CID 9201217

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone?
The IUPAC name of 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone (CID 8910906) is 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone.
What is the SMILES notation for 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone?
The canonical SMILES for 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone is COc1ccc(CC(=O)N2CCN(c3ccccc3C)CC2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone?
The InChIKey is AEEGFGJZQRYZKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-16-5-3-4-6-19(16)21-11-13-22(14-12-21)20(23)15-17-7-9-18(24-2)10-8-17/h3-10H,11-15H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone?
2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone has a molecular weight of 324.42 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-1-[4-(2-methylphenyl)piperazin-1-yl]ethanone is sourced from PubChem (CID 8910906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).