2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine

C15H32N2 — CID 64847164

IUPAC2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine
SMILESCCC(C)C1CNC(C)(CC)CN1CC(C)C
InChIInChI=1S/C15H32N2/c1-7-13(5)14-9-16-15(6,8-2)11-17(14)10-12(3)4/h12-14,16H,7-11H2,1-6H3
InChIKeyDKNBTJXSFFMGQV-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.13
Rot. Bonds5

About 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine

2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine (PubChem CID 64847164) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine
PubChem CID64847164
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine
SMILESCCC(C)C1CNC(C)(CC)CN1CC(C)C
InChIInChI=1S/C15H32N2/c1-7-13(5)14-9-16-15(6,8-2)11-17(14)10-12(3)4/h12-14,16H,7-11H2,1-6H3
InChIKeyDKNBTJXSFFMGQV-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine?
The IUPAC name of 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine (CID 64847164) is 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine.
What is the SMILES notation for 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine?
The canonical SMILES for 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine is CCC(C)C1CNC(C)(CC)CN1CC(C)C.
What is the InChIKey of 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine?
The InChIKey is DKNBTJXSFFMGQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-7-13(5)14-9-16-15(6,8-2)11-17(14)10-12(3)4/h12-14,16H,7-11H2,1-6H3.
What are the key properties of 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine?
2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine has a molecular weight of 240.43 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-5-ethyl-5-methyl-1-(2-methylpropyl)piperazine is sourced from PubChem (CID 64847164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).