1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione

C14H24N2O2 — CID 64968246

IUPAC1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)CN(C2(C)CCCCC2)C1=O
InChIInChI=1S/C14H24N2O2/c1-3-7-11-13(18)16(10-12(17)15-11)14(2)8-5-4-6-9-14/h11H,3-10H2,1-2H3,(H,15,17)
InChIKeyHEBKPCXLPDIXCJ-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.84
Rot. Bonds3

About 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione

1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione (PubChem CID 64968246) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione
PubChem CID64968246
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione
SMILESCCCC1NC(=O)CN(C2(C)CCCCC2)C1=O
InChIInChI=1S/C14H24N2O2/c1-3-7-11-13(18)16(10-12(17)15-11)14(2)8-5-4-6-9-14/h11H,3-10H2,1-2H3,(H,15,17)
InChIKeyHEBKPCXLPDIXCJ-UHFFFAOYSA-N
XLogP1.84
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(1-methylcyclopentyl)methyl]-3-propylpiperazine-2,5-dione
CID 64971362
1-(1-methylcyclohexyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64968342
1-(4,4-dimethylcyclohexyl)-3-propylpiperazine-2,5-dione
CID 64972911
3-tert-butyl-1-(1-methylcyclopentyl)piperazine-2,5-dione
CID 64973656
3-propyl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine-2,5-dione
CID 79351163
1-(1,1-dioxothian-3-yl)-3-propylpiperazine-2,5-dione
CID 64971666
1-butyl-3-propylpiperazine-2,5-dione
CID 64879982
1-(1-methylcyclopentyl)-3-(2-methylpropyl)-1,4-diazepane-2,5-dione
CID 64973589
1-(1-cyclohexylpropyl)-3-propylpiperazine-2,5-dione
CID 64969313
1,3-dipropyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64872406
1-cyclopentyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 82924283
1-(oxan-3-yl)-3-propylpiperazine-2,5-dione
CID 64971351

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione?
The IUPAC name of 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione (CID 64968246) is 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione.
What is the SMILES notation for 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione?
The canonical SMILES for 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione is CCCC1NC(=O)CN(C2(C)CCCCC2)C1=O.
What is the InChIKey of 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione?
The InChIKey is HEBKPCXLPDIXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-7-11-13(18)16(10-12(17)15-11)14(2)8-5-4-6-9-14/h11H,3-10H2,1-2H3,(H,15,17).
What are the key properties of 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione?
1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclohexyl)-3-propylpiperazine-2,5-dione is sourced from PubChem (CID 64968246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).