1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione

C16H28N2O2 — CID 64874943

IUPAC1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione
SMILESCCCC1NC(=O)C(CCC)N(CC2CCCC2)C1=O
InChIInChI=1S/C16H28N2O2/c1-3-7-13-16(20)18(11-12-9-5-6-10-12)14(8-4-2)15(19)17-13/h12-14H,3-11H2,1-2H3,(H,17,19)
InChIKeyUEBYBUCZAXEONB-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.47
Rot. Bonds6

About 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione

1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione (PubChem CID 64874943) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione.

Molecular Properties

Compound Name1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione
PubChem CID64874943
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione
SMILESCCCC1NC(=O)C(CCC)N(CC2CCCC2)C1=O
InChIInChI=1S/C16H28N2O2/c1-3-7-13-16(20)18(11-12-9-5-6-10-12)14(8-4-2)15(19)17-13/h12-14H,3-11H2,1-2H3,(H,17,19)
InChIKeyUEBYBUCZAXEONB-UHFFFAOYSA-N
XLogP2.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopentylmethyl)-3,6-diethylpiperazine-2,5-dione
CID 64902210
1-(cyclopropylmethyl)-3-(2-methylpropyl)-6-propylpiperazine-2,5-dione
CID 64900957
1,3,6-tripropylpiperazine-2,5-dione
CID 64873955
6-cyclopropyl-1-(cyclopropylmethyl)-3-propylpiperazine-2,5-dione
CID 64874160
1-(2-fluoroethyl)-3,6-dipropylpiperazine-2,5-dione
CID 80698187
1-(cyclohex-3-en-1-ylmethyl)-6-ethyl-3-propylpiperazine-2,5-dione
CID 64968016
1-(2-ethylbutyl)-3,6-dipropylpiperazine-2,5-dione
CID 82934942
3,6-diethyl-1-[(4-methylcyclohexyl)methyl]piperazine-2,5-dione
CID 64970352
3,6-diethyl-1-[(4-ethylcyclohexyl)methyl]piperazine-2,5-dione
CID 64968208
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
1-(2-cyclohexylethyl)-3,6-diethylpiperazine-2,5-dione
CID 64964026
6-ethyl-1-(2-methylcyclohexyl)-3-propylpiperazine-2,5-dione
CID 64959124

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione?
The IUPAC name of 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione (CID 64874943) is 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione.
What is the SMILES notation for 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione?
The canonical SMILES for 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione is CCCC1NC(=O)C(CCC)N(CC2CCCC2)C1=O.
What is the InChIKey of 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione?
The InChIKey is UEBYBUCZAXEONB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-3-7-13-16(20)18(11-12-9-5-6-10-12)14(8-4-2)15(19)17-13/h12-14H,3-11H2,1-2H3,(H,17,19).
What are the key properties of 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione?
1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione has a molecular weight of 280.41 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylmethyl)-3,6-dipropylpiperazine-2,5-dione is sourced from PubChem (CID 64874943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).