2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone

C14H26N4O2 — CID 70672247

IUPAC2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone
SMILESCCN1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1
InChIInChI=1S/C14H26N4O2/c1-3-15-4-10-18(11-5-15)14(20)12-16-6-8-17(9-7-16)13(2)19/h3-12H2,1-2H3
InChIKeyCPMUOTRSISNKKI-UHFFFAOYSA-N
MW282.39 g/mol
LogP-0.69
Rot. Bonds3

About 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone

2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone (PubChem CID 70672247) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone
PubChem CID70672247
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone
SMILESCCN1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1
InChIInChI=1S/C14H26N4O2/c1-3-15-4-10-18(11-5-15)14(20)12-16-6-8-17(9-7-16)13(2)19/h3-12H2,1-2H3
InChIKeyCPMUOTRSISNKKI-UHFFFAOYSA-N
XLogP-0.69
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-0.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone?
The IUPAC name of 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone (CID 70672247) is 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone is CCN1CCN(C(=O)CN2CCN(C(C)=O)CC2)CC1.
What is the InChIKey of 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone?
The InChIKey is CPMUOTRSISNKKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-3-15-4-10-18(11-5-15)14(20)12-16-6-8-17(9-7-16)13(2)19/h3-12H2,1-2H3.
What are the key properties of 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone?
2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone has a molecular weight of 282.39 g/mol, XLogP of -0.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazin-1-yl)-1-(4-ethylpiperazin-1-yl)ethanone is sourced from PubChem (CID 70672247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).