1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione

C14H24N2O2 — CID 82936542

IUPAC1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione
SMILESCCC1(C)C(=O)NC(C)C(=O)N1C1CCCCC1
InChIInChI=1S/C14H24N2O2/c1-4-14(3)13(18)15-10(2)12(17)16(14)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3,(H,15,18)
InChIKeyHFJARCFWZSISNA-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.83
Rot. Bonds2

About 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione

1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione (PubChem CID 82936542) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione
PubChem CID82936542
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione
SMILESCCC1(C)C(=O)NC(C)C(=O)N1C1CCCCC1
InChIInChI=1S/C14H24N2O2/c1-4-14(3)13(18)15-10(2)12(17)16(14)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3,(H,15,18)
InChIKeyHFJARCFWZSISNA-UHFFFAOYSA-N
XLogP1.83
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cycloheptyl-6-ethyl-6-methyl-3-propylpiperazine-2,5-dione
CID 82924165
1-cyclopentyl-6-ethyl-3,3,6-trimethylpiperazine-2,5-dione
CID 82936461
1-(cyclopentylmethyl)-6-ethyl-3,6-dimethylpiperazine-2,5-dione
CID 64873515
6-ethyl-3,6-dimethyl-1-propylpiperazine-2,5-dione
CID 64874502
6-ethyl-6-methyl-1-(oxolan-3-yl)-3-propan-2-ylpiperazine-2,5-dione
CID 64874208
(5S)-3-cyclopentyl-5-methylimidazolidine-2,4-dione
CID 131182792
3,6-diethyl-6-methyl-1-(oxolan-3-yl)piperazine-2,5-dione
CID 64902249
1-cyclohexyl-6,6-diethyl-3-propylpiperazine-2,5-dione
CID 82924166
6-ethyl-6-methyl-3-(2-methylpropyl)-1-(oxolan-3-yl)piperazine-2,5-dione
CID 64901545
1-cyclohexyl-4-ethoxy-5,5-dimethylimidazolidine-2-thione
CID 4578430
1-cycloheptyl-3-methyl-6-(2-methylpropyl)piperazine-2,5-dione
CID 82936794
1-(cyclopentylmethyl)-6,6-diethyl-3-methylpiperazine-2,5-dione
CID 64873323

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione?
The IUPAC name of 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione (CID 82936542) is 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione.
What is the SMILES notation for 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione?
The canonical SMILES for 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione is CCC1(C)C(=O)NC(C)C(=O)N1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione?
The InChIKey is HFJARCFWZSISNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-4-14(3)13(18)15-10(2)12(17)16(14)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3,(H,15,18).
What are the key properties of 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione?
1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-6-ethyl-3,6-dimethylpiperazine-2,5-dione is sourced from PubChem (CID 82936542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).