6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione

C15H28N2O2 — CID 64872873

IUPAC6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCCCC(C)CN1C(=O)C(C(C)C)NC(=O)C1CC
InChIInChI=1S/C15H28N2O2/c1-6-8-11(5)9-17-12(7-2)14(18)16-13(10(3)4)15(17)19/h10-13H,6-9H2,1-5H3,(H,16,18)
InChIKeyUXBBCMHBEFFFMC-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.18
Rot. Bonds6

About 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione

6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione (PubChem CID 64872873) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione.

Molecular Properties

Compound Name6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione
PubChem CID64872873
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione
SMILESCCCC(C)CN1C(=O)C(C(C)C)NC(=O)C1CC
InChIInChI=1S/C15H28N2O2/c1-6-8-11(5)9-17-12(7-2)14(18)16-13(10(3)4)15(17)19/h10-13H,6-9H2,1-5H3,(H,16,18)
InChIKeyUXBBCMHBEFFFMC-UHFFFAOYSA-N
XLogP2.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione with MolForge

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Related Compounds

3-butan-2-yl-6-methyl-1-(2-methylpentyl)piperazine-2,5-dione
CID 64901941
6-ethyl-1-[(2-methylcyclopropyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 113464219
6-ethyl-1-[(3-methylcyclopentyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 107415616
6-ethyl-1-(3-methoxypropyl)-3-propan-2-ylpiperazine-2,5-dione
CID 64874647
1-(3-ethoxypropyl)-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64959207
6-ethyl-1-[(2-methylcyclohexyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64967164
6-ethyl-1-[(2-methylphenyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 64873857
1-cyclobutyl-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64969387
1-[(1,1-dioxothiolan-3-yl)methyl]-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64968952
1-[(4,5-dimethylthiophen-2-yl)methyl]-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 65244955
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 79232203
1-cycloheptyl-6-ethyl-3-propan-2-ylpiperazine-2,5-dione
CID 64960299

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione?
The IUPAC name of 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione (CID 64872873) is 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione.
What is the SMILES notation for 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione?
The canonical SMILES for 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione is CCCC(C)CN1C(=O)C(C(C)C)NC(=O)C1CC.
What is the InChIKey of 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione?
The InChIKey is UXBBCMHBEFFFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-6-8-11(5)9-17-12(7-2)14(18)16-13(10(3)4)15(17)19/h10-13H,6-9H2,1-5H3,(H,16,18).
What are the key properties of 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione?
6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione has a molecular weight of 268.40 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-1-(2-methylpentyl)-3-propan-2-ylpiperazine-2,5-dione is sourced from PubChem (CID 64872873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).