1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione

C12H20N2O2 — CID 64964119

IUPAC1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione
SMILESCC1NC(=O)CN(CCC2CCCC2)C1=O
InChIInChI=1S/C12H20N2O2/c1-9-12(16)14(8-11(15)13-9)7-6-10-4-2-3-5-10/h9-10H,2-8H2,1H3,(H,13,15)
InChIKeyZYTSXUQUSWLFQM-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.91
Rot. Bonds3

About 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione

1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione (PubChem CID 64964119) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione
PubChem CID64964119
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione
SMILESCC1NC(=O)CN(CCC2CCCC2)C1=O
InChIInChI=1S/C12H20N2O2/c1-9-12(16)14(8-11(15)13-9)7-6-10-4-2-3-5-10/h9-10H,2-8H2,1H3,(H,13,15)
InChIKeyZYTSXUQUSWLFQM-UHFFFAOYSA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-[2-(3-methylcyclohexyl)ethyl]piperazine-2,5-dione
CID 64972368
1-(2-cyclohexylethyl)-3,3-dimethylpiperazine-2,5-dione
CID 64964121
3-methyl-1-[3-(oxolan-2-yl)propyl]piperazine-2,5-dione
CID 65170302
3-methyl-1-(2-propan-2-yloxyethyl)piperazine-2,5-dione
CID 64880984
3-butan-2-yl-1-[2-(1-methylpiperidin-4-yl)ethyl]piperazine-2,5-dione
CID 114516865
1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperazine-2,5-dione
CID 64880925
4-(2-cyclohexylethyl)piperazine-2,6-dione
CID 63787691
1-(3-imidazol-1-ylpropyl)-3-methylpiperazine-2,5-dione
CID 64881186
2-(2-cyclohexylethyl)-3,6,7,8,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione
CID 79929577
3-(2-cyclopentylethyl)-5-ethyl-5-methylimidazolidin-4-one
CID 83256191
(3S)-1-tert-butyl-3-methylpiperazine-2,5-dione
CID 170050689
3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
CID 79078126

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione?
The IUPAC name of 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione (CID 64964119) is 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione.
What is the SMILES notation for 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione?
The canonical SMILES for 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione is CC1NC(=O)CN(CCC2CCCC2)C1=O.
What is the InChIKey of 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione?
The InChIKey is ZYTSXUQUSWLFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-9-12(16)14(8-11(15)13-9)7-6-10-4-2-3-5-10/h9-10H,2-8H2,1H3,(H,13,15).
What are the key properties of 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione?
1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione has a molecular weight of 224.30 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopentylethyl)-3-methylpiperazine-2,5-dione is sourced from PubChem (CID 64964119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).