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

C9H19N3O — CID 24706244

IUPAC1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone
SMILESCCN1CCN(C(=O)CNC)CC1
InChIInChI=1S/C9H19N3O/c1-3-11-4-6-12(7-5-11)9(13)8-10-2/h10H,3-8H2,1-2H3
InChIKeyAMVHZNXURZUYBM-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.63
Rot. Bonds3

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

1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone (PubChem CID 24706244) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone.

Molecular Properties

Compound Name1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone
PubChem CID24706244
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone
SMILESCCN1CCN(C(=O)CNC)CC1
InChIInChI=1S/C9H19N3O/c1-3-11-4-6-12(7-5-11)9(13)8-10-2/h10H,3-8H2,1-2H3
InChIKeyAMVHZNXURZUYBM-UHFFFAOYSA-N
XLogP-0.63
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethylpiperazin-1-yl)-2-[1-[2-(methylamino)acetyl]piperidin-4-yl]ethanone;hydrochloride
CID 120704431
1,3-bis(4-ethylpiperazin-1-yl)propane-1,3-dione
CID 108944495
1-[4-(2-fluoroethyl)piperazin-1-yl]-2-(methylamino)ethanone
CID 121201948
1-(7-ethyl-2,7-diazaspiro[3.5]nonan-2-yl)-2-(methylamino)ethanone
CID 164556916
2-(methylamino)-1-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethanone
CID 61260523
ethyl 4-[2-(methylamino)acetyl]piperazine-1-carboxylate
CID 54773405
2-amino-N-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]acetamide
CID 60847921
1-[4-(2-ethoxyethyl)piperazin-1-yl]-2-(methylamino)ethanone;hydrochloride
CID 120704458
ethane;7-[4-[2-(methylamino)acetyl]piperazin-1-yl]heptan-3-one
CID 169190267
2-(methylamino)-1-(4-propan-2-ylpiperidin-1-yl)ethanone
CID 59542495
2,2-dimethyl-1-[4-[2-(methylamino)acetyl]piperazin-1-yl]propan-1-one
CID 83634925
1-[4-(2-methoxyacetyl)piperazin-1-yl]-2-(methylamino)ethanone
CID 60947029

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone?
The IUPAC name of 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone (CID 24706244) is 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone.
What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone?
The canonical SMILES for 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone is CCN1CCN(C(=O)CNC)CC1.
What is the InChIKey of 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone?
The InChIKey is AMVHZNXURZUYBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-3-11-4-6-12(7-5-11)9(13)8-10-2/h10H,3-8H2,1-2H3.
What are the key properties of 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone?
1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone has a molecular weight of 185.27 g/mol, XLogP of -0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperazin-1-yl)-2-(methylamino)ethanone is sourced from PubChem (CID 24706244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).