6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione

C15H26N2O2 — CID 64887009

IUPAC6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione
SMILESCCC1(C)NC(=O)C(C2CC2)N(CCC(C)C)C1=O
InChIInChI=1S/C15H26N2O2/c1-5-15(4)14(19)17(9-8-10(2)3)12(11-6-7-11)13(18)16-15/h10-12H,5-9H2,1-4H3,(H,16,18)
InChIKeyPDYCTBJGBATJET-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.94
Rot. Bonds5

About 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione

6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione (PubChem CID 64887009) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione.

Molecular Properties

Compound Name6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione
PubChem CID64887009
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione
SMILESCCC1(C)NC(=O)C(C2CC2)N(CCC(C)C)C1=O
InChIInChI=1S/C15H26N2O2/c1-5-15(4)14(19)17(9-8-10(2)3)12(11-6-7-11)13(18)16-15/h10-12H,5-9H2,1-4H3,(H,16,18)
InChIKeyPDYCTBJGBATJET-UHFFFAOYSA-N
XLogP1.94
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
The IUPAC name of 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione (CID 64887009) is 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione.
What is the SMILES notation for 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
The canonical SMILES for 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione is CCC1(C)NC(=O)C(C2CC2)N(CCC(C)C)C1=O.
What is the InChIKey of 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
The InChIKey is PDYCTBJGBATJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-5-15(4)14(19)17(9-8-10(2)3)12(11-6-7-11)13(18)16-15/h10-12H,5-9H2,1-4H3,(H,16,18).
What are the key properties of 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione?
6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione has a molecular weight of 266.38 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-ethyl-3-methyl-1-(3-methylbutyl)piperazine-2,5-dione is sourced from PubChem (CID 64887009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).