1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione

C15H26N2O2 — CID 64973434

IUPAC1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione
SMILESCCC1C(=O)NC(C)C(=O)N1C1CCC(C)C(C)C1
InChIInChI=1S/C15H26N2O2/c1-5-13-14(18)16-11(4)15(19)17(13)12-7-6-9(2)10(3)8-12/h9-13H,5-8H2,1-4H3,(H,16,18)
InChIKeyPZLPNGGSFMYIAL-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.94
Rot. Bonds2

About 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione

1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione (PubChem CID 64973434) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione
PubChem CID64973434
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione
SMILESCCC1C(=O)NC(C)C(=O)N1C1CCC(C)C(C)C1
InChIInChI=1S/C15H26N2O2/c1-5-13-14(18)16-11(4)15(19)17(13)12-7-6-9(2)10(3)8-12/h9-13H,5-8H2,1-4H3,(H,16,18)
InChIKeyPZLPNGGSFMYIAL-UHFFFAOYSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylcyclohexyl)-6-ethyl-3,3-dimethylpiperazine-2,5-dione
CID 64973398
3-tert-butyl-6-ethyl-1-(4-methylcyclohexyl)piperazine-2,5-dione
CID 64959537
3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one
CID 83263458
1-(2,2-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione
CID 79877831
6-ethyl-1-(2-methoxycyclopentyl)-3-methylpiperazine-2,5-dione
CID 64968404
1-cyclohexyl-3,6-diethylpiperazine-2,5-dione
CID 64958819
6-ethyl-1-(4-ethylcyclohexyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64964865
3-(3,4-dimethylcyclohexyl)-5-methylimidazolidin-4-one
CID 83264832
3-cyclopropyl-1-(3,4-dimethylcyclohexyl)-6-methylpiperazine-2,5-dione
CID 64973689
1-cyclobutyl-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64969387
1-cycloheptyl-3-cyclopropyl-6-ethylpiperazine-2,5-dione
CID 64959657
5-butan-2-yl-3-(3,4-dimethylcyclohexyl)-2-methylimidazolidin-4-one
CID 83263151

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione?
The IUPAC name of 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione (CID 64973434) is 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione.
What is the SMILES notation for 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione?
The canonical SMILES for 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione is CCC1C(=O)NC(C)C(=O)N1C1CCC(C)C(C)C1.
What is the InChIKey of 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione?
The InChIKey is PZLPNGGSFMYIAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-5-13-14(18)16-11(4)15(19)17(13)12-7-6-9(2)10(3)8-12/h9-13H,5-8H2,1-4H3,(H,16,18).
What are the key properties of 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione?
1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione is sourced from PubChem (CID 64973434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).