2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine

C16H34N2 — CID 64838710

IUPAC2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine
SMILESCCCCC(CC)CN1CC(C)(C)NCC1CC
InChIInChI=1S/C16H34N2/c1-6-9-10-14(7-2)12-18-13-16(4,5)17-11-15(18)8-3/h14-15,17H,6-13H2,1-5H3
InChIKeyPRBAJOPBDKHXEB-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.67
Rot. Bonds7

About 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine

2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine (PubChem CID 64838710) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine.

Molecular Properties

Compound Name2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine
PubChem CID64838710
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine
SMILESCCCCC(CC)CN1CC(C)(C)NCC1CC
InChIInChI=1S/C16H34N2/c1-6-9-10-14(7-2)12-18-13-16(4,5)17-11-15(18)8-3/h14-15,17H,6-13H2,1-5H3
InChIKeyPRBAJOPBDKHXEB-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine?
The IUPAC name of 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine (CID 64838710) is 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine.
What is the SMILES notation for 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine?
The canonical SMILES for 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine is CCCCC(CC)CN1CC(C)(C)NCC1CC.
What is the InChIKey of 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine?
The InChIKey is PRBAJOPBDKHXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-6-9-10-14(7-2)12-18-13-16(4,5)17-11-15(18)8-3/h14-15,17H,6-13H2,1-5H3.
What are the key properties of 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine?
2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine has a molecular weight of 254.46 g/mol, XLogP of 3.67, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine is sourced from PubChem (CID 64838710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).