1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione

C16H28N2O2 — CID 64969249

IUPAC1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCC1NC(=O)C(C(C)C)N(C(C)C2CCCCC2)C1=O
InChIInChI=1S/C16H28N2O2/c1-10(2)14-15(19)17-11(3)16(20)18(14)12(4)13-8-6-5-7-9-13/h10-14H,5-9H2,1-4H3,(H,17,19)
InChIKeyOLBVHLPWOPSOIT-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.33
Rot. Bonds3

About 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione

1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione (PubChem CID 64969249) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
PubChem CID64969249
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
SMILESCC1NC(=O)C(C(C)C)N(C(C)C2CCCCC2)C1=O
InChIInChI=1S/C16H28N2O2/c1-10(2)14-15(19)17-11(3)16(20)18(14)12(4)13-8-6-5-7-9-13/h10-14H,5-9H2,1-4H3,(H,17,19)
InChIKeyOLBVHLPWOPSOIT-UHFFFAOYSA-N
XLogP2.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-cyclohexylethyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255331
1-(1-cyclopentylethyl)-6-methyl-3-propan-2-ylpiperazine-2,5-dione
CID 64972264
1-(1-cyclohexylethyl)-3-cyclopropyl-6-methylpiperazine-2,5-dione
CID 64969309
3-methyl-1-(1-methylcyclohexyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64968328
3-(1-cyclopentylethyl)-2-ethyl-5-methylimidazolidin-4-one
CID 83264545
1-(1-cyclohexylethyl)-3,3,6-trimethylpiperazine-2,5-dione
CID 64969145
1-(1-methoxy-3-methylbutan-2-yl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 65053001
3-(1-cyclopropylethyl)-2,5-dimethylimidazolidin-4-one
CID 83243859
1-(2,2-dimethylcyclohexyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 79878671
3-methyl-1-[1-(5-methylfuran-2-yl)ethyl]-6-propan-2-ylpiperazine-2,5-dione
CID 64965003
3-methyl-1-(2-methylpropyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64872902
1-(2-cyclopentyloxyethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 64971200

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione (CID 64969249) is 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione is CC1NC(=O)C(C(C)C)N(C(C)C2CCCCC2)C1=O.
What is the InChIKey of 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
The InChIKey is OLBVHLPWOPSOIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-10(2)14-15(19)17-11(3)16(20)18(14)12(4)13-8-6-5-7-9-13/h10-14H,5-9H2,1-4H3,(H,17,19).
What are the key properties of 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione?
1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione has a molecular weight of 280.41 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylethyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64969249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).