2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone

C15H22N2O2 — CID 43219308

IUPAC2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone
SMILESCCN1CCN(CC(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-3-16-7-9-17(10-8-16)12-15(18)13-5-4-6-14(11-13)19-2/h4-6,11H,3,7-10,12H2,1-2H3
InChIKeyDGSQFGHZCWKNDQ-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.52
Rot. Bonds5

About 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone

2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone (PubChem CID 43219308) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone
PubChem CID43219308
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone
SMILESCCN1CCN(CC(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-3-16-7-9-17(10-8-16)12-15(18)13-5-4-6-14(11-13)19-2/h4-6,11H,3,7-10,12H2,1-2H3
InChIKeyDGSQFGHZCWKNDQ-UHFFFAOYSA-N
XLogP1.52
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(3-methoxyphenyl)-2-oxoethyl]piperazine-1-carbaldehyde
CID 82121920
2-(4-aminopiperidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 56828695
2-[4-(4-fluorophenyl)piperazin-1-yl]-1-(3-methoxyphenyl)ethanone
CID 5090901
1-(3,4-dimethoxyphenyl)-2-[4-(3-methoxybenzoyl)piperazin-1-yl]ethanone
CID 110368800
2-(3-aminoazetidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 121200257
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-(3-methoxyphenyl)ethanone
CID 93026009
2-(3-hydroxypiperidin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 56829037
1-(3-methoxyphenyl)-3-[3-[2-(4-methylpiperazin-1-yl)acetyl]phenyl]urea
CID 170861674
1-(3-methoxyphenyl)propan-1-one;propane
CID 142960525
1-[3-(4-methoxyphenyl)phenyl]-2-(4-methylpiperazin-1-yl)ethanone
CID 170862095
N-[1-[2-(3-methoxyphenyl)-2-oxoethyl]piperidin-4-yl]cyclohexanecarboxamide
CID 3220971
[4-[6-(4-ethylpiperazin-1-yl)pyridazin-3-yl]piperazin-1-yl]-(3-methoxyphenyl)methanone
CID 121038204

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone?
The IUPAC name of 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone (CID 43219308) is 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone?
The canonical SMILES for 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone is CCN1CCN(CC(=O)c2cccc(OC)c2)CC1.
What is the InChIKey of 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone?
The InChIKey is DGSQFGHZCWKNDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-16-7-9-17(10-8-16)12-15(18)13-5-4-6-14(11-13)19-2/h4-6,11H,3,7-10,12H2,1-2H3.
What are the key properties of 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone?
2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone has a molecular weight of 262.35 g/mol, XLogP of 1.52, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylpiperazin-1-yl)-1-(3-methoxyphenyl)ethanone is sourced from PubChem (CID 43219308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).