1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione

C14H26N2O4 — CID 64872364

IUPAC1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
SMILESCOCCOCCN1C(=O)C(C)NC(=O)C1CC(C)C
InChIInChI=1S/C14H26N2O4/c1-10(2)9-12-13(17)15-11(3)14(18)16(12)5-6-20-8-7-19-4/h10-12H,5-9H2,1-4H3,(H,15,17)
InChIKeyHACLKWDHHOVUNP-UHFFFAOYSA-N
MW286.37 g/mol
LogP0.41
Rot. Bonds8

About 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione

1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione (PubChem CID 64872364) has the molecular formula C14H26N2O4 and a molecular weight of 286.37 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
PubChem CID64872364
Molecular FormulaC14H26N2O4
Molecular Weight286.37 g/mol
Exact Mass286.19
IUPAC Name1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
SMILESCOCCOCCN1C(=O)C(C)NC(=O)C1CC(C)C
InChIInChI=1S/C14H26N2O4/c1-10(2)9-12-13(17)15-11(3)14(18)16(12)5-6-20-8-7-19-4/h10-12H,5-9H2,1-4H3,(H,15,17)
InChIKeyHACLKWDHHOVUNP-UHFFFAOYSA-N
XLogP0.41
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-ethyl-1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-2,5-dione
CID 64873869
6-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-2,5-dione
CID 64874482
1-(2-methoxyethyl)-6-(2-methylpropyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64873401
3-methyl-6-(2-methylpropyl)-1-(4,4,4-trifluorobutyl)piperazine-2,5-dione
CID 115519220
3-methyl-6-(2-methylpropyl)-1-[2-(trifluoromethylsulfanyl)ethyl]piperazine-2,5-dione
CID 116627625
3-[2-(2-methoxyethoxy)ethyl]-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83255782
3-methyl-1-[2-(1-methylimidazol-2-yl)ethyl]-6-(2-methylpropyl)piperazine-2,5-dione
CID 114532459
1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-2,5-dione
CID 64880925
6-ethyl-3-methyl-1-(3-propoxypropyl)piperazine-2,5-dione
CID 82947001
3-(2-ethoxyethyl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83236846
1-(3-methylbutyl)-3,6-bis(2-methylpropyl)piperazine-2,5-dione
CID 64902109
3,3-dimethyl-1-[2-(2-methylpropoxy)ethyl]-6-(2-methylpropyl)piperazine-2,5-dione
CID 106458979

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione?
The IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione (CID 64872364) is 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione?
The canonical SMILES for 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione is COCCOCCN1C(=O)C(C)NC(=O)C1CC(C)C.
What is the InChIKey of 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione?
The InChIKey is HACLKWDHHOVUNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O4/c1-10(2)9-12-13(17)15-11(3)14(18)16(12)5-6-20-8-7-19-4/h10-12H,5-9H2,1-4H3,(H,15,17).
What are the key properties of 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione?
1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione has a molecular weight of 286.37 g/mol, XLogP of 0.41, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)ethyl]-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione is sourced from PubChem (CID 64872364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).