1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride

C14H26ClN3O4 — CID 110283521

IUPAC1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride
SMILESCCOCCN1CCNC(CC(=O)N2CCOCC2)C1=O.Cl
InChIInChI=1S/C14H25N3O4.ClH/c1-2-20-8-7-17-4-3-15-12(14(17)19)11-13(18)16-5-9-21-10-6-16;/h12,15H,2-11H2,1H3;1H
InChIKeyQQNMHDWDDYVXGE-UHFFFAOYSA-N
MW335.83 g/mol
LogP-0.51
Rot. Bonds6

About 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride

1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride (PubChem CID 110283521) has the molecular formula C14H26ClN3O4 and a molecular weight of 335.83 g/mol. Its IUPAC name is 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride.

Molecular Properties

Compound Name1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride
PubChem CID110283521
Molecular FormulaC14H26ClN3O4
Molecular Weight335.83 g/mol
Exact Mass335.16
IUPAC Name1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride
SMILESCCOCCN1CCNC(CC(=O)N2CCOCC2)C1=O.Cl
InChIInChI=1S/C14H25N3O4.ClH/c1-2-20-8-7-17-4-3-15-12(14(17)19)11-13(18)16-5-9-21-10-6-16;/h12,15H,2-11H2,1H3;1H
InChIKeyQQNMHDWDDYVXGE-UHFFFAOYSA-N
XLogP-0.51
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.83
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[4-(2-ethoxyethyl)-3-oxopiperazin-2-yl]acetamide
CID 110283554
2-[4-(2-ethoxyethyl)-3-oxopiperazin-2-yl]-N-(2-hydroxyethyl)acetamide;hydrochloride
CID 110283561
1-(2-methoxyethyl)-3-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperazin-2-one;hydrochloride
CID 110282942
3-(2-oxo-2-pyrrolidin-1-ylethyl)-1-propylpiperazin-2-one
CID 110282733
1-(cyclopropylmethyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperazin-2-one;hydrochloride
CID 110282647
1-(cyclopropylmethyl)-3-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-2-one;hydrochloride
CID 110282635
2-[4-(2-methoxyethyl)-3-oxopiperazin-2-yl]-N,N-dipropylacetamide;hydrochloride
CID 110282954
3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1-prop-2-enylpiperazin-2-one;hydrochloride
CID 110283038
N,N-dimethyl-2-(3-oxo-4-propylpiperazin-2-yl)acetamide;hydrochloride
CID 110282730
ethyl 2-(4-ethyl-3-oxopiperazin-2-yl)acetate
CID 110282529
3-[2-(azepan-1-yl)-2-oxoethyl]-1-(cyclobutylmethyl)piperazin-2-one
CID 110283438
1-(2-fluoroethyl)-3-[2-(3-hydroxypyrrolidin-1-yl)-2-oxoethyl]piperazin-2-one;hydrochloride
CID 110283321

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride?
The IUPAC name of 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride (CID 110283521) is 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride.
What is the SMILES notation for 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride?
The canonical SMILES for 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride is CCOCCN1CCNC(CC(=O)N2CCOCC2)C1=O.Cl.
What is the InChIKey of 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride?
The InChIKey is QQNMHDWDDYVXGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4.ClH/c1-2-20-8-7-17-4-3-15-12(14(17)19)11-13(18)16-5-9-21-10-6-16;/h12,15H,2-11H2,1H3;1H.
What are the key properties of 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride?
1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride has a molecular weight of 335.83 g/mol, XLogP of -0.51, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyethyl)-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-2-one;hydrochloride is sourced from PubChem (CID 110283521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).