2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine

C16H34N2 — CID 114102126

IUPAC2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine
SMILESCCC1CNC(C(C)C)CN1CC(C)(C)C(C)C
InChIInChI=1S/C16H34N2/c1-8-14-9-17-15(12(2)3)10-18(14)11-16(6,7)13(4)5/h12-15,17H,8-11H2,1-7H3
InChIKeyOZIJXHWSBYRZOG-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.38
Rot. Bonds5

About 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine

2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine (PubChem CID 114102126) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine.

Molecular Properties

Compound Name2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine
PubChem CID114102126
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine
SMILESCCC1CNC(C(C)C)CN1CC(C)(C)C(C)C
InChIInChI=1S/C16H34N2/c1-8-14-9-17-15(12(2)3)10-18(14)11-16(6,7)13(4)5/h12-15,17H,8-11H2,1-7H3
InChIKeyOZIJXHWSBYRZOG-UHFFFAOYSA-N
XLogP3.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4,4-dimethylpentyl)-2-ethyl-5-propan-2-ylpiperazine
CID 114210392
2-ethyl-5-propan-2-yl-1-prop-2-ynylpiperazine
CID 64937339
2-ethyl-1-hexyl-5-propan-2-ylpiperazine
CID 64833921
5-butan-2-yl-2-ethyl-1-(2,2,3,3-tetrafluoropropyl)piperazine
CID 106294228
1-(3,3-dimethylbutyl)-5-propan-2-yl-2-propylpiperazine
CID 64832139
2-ethyl-1-(3-ethylsulfonylpropyl)-5-propan-2-ylpiperazine
CID 65097314
2-ethyl-1-[(4-methylphenyl)methyl]-5-propan-2-ylpiperazine
CID 64832516
2-ethyl-1-[(2-methylcyclopentyl)methyl]-5-propan-2-ylpiperazine
CID 107420868
1-(2-butoxyethyl)-2-ethyl-5-propan-2-ylpiperazine
CID 64834120
2-ethyl-5-propan-2-yl-1-(pyridin-3-ylmethyl)piperazine
CID 64831744
2-ethyl-1-[(6-methyl-3-pyridinyl)methyl]-5-propan-2-ylpiperazine
CID 64938382
2-ethyl-1-[(2-methylphenyl)methyl]-5-propan-2-ylpiperazine
CID 64831533

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine?
The IUPAC name of 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine (CID 114102126) is 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine.
What is the SMILES notation for 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine?
The canonical SMILES for 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine is CCC1CNC(C(C)C)CN1CC(C)(C)C(C)C.
What is the InChIKey of 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine?
The InChIKey is OZIJXHWSBYRZOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-8-14-9-17-15(12(2)3)10-18(14)11-16(6,7)13(4)5/h12-15,17H,8-11H2,1-7H3.
What are the key properties of 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine?
2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine has a molecular weight of 254.46 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-propan-2-yl-1-(2,2,3-trimethylbutyl)piperazine is sourced from PubChem (CID 114102126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).