2,2-diethyl-1-(2-phenoxyethyl)piperazine

C16H26N2O — CID 64846196

IUPAC2,2-diethyl-1-(2-phenoxyethyl)piperazine
SMILESCCC1(CC)CNCCN1CCOc1ccccc1
InChIInChI=1S/C16H26N2O/c1-3-16(4-2)14-17-10-11-18(16)12-13-19-15-8-6-5-7-9-15/h5-9,17H,3-4,10-14H2,1-2H3
InChIKeyOPQDVRLSAOOFHL-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.53
Rot. Bonds6

About 2,2-diethyl-1-(2-phenoxyethyl)piperazine

2,2-diethyl-1-(2-phenoxyethyl)piperazine (PubChem CID 64846196) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2,2-diethyl-1-(2-phenoxyethyl)piperazine.

Molecular Properties

Compound Name2,2-diethyl-1-(2-phenoxyethyl)piperazine
PubChem CID64846196
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2,2-diethyl-1-(2-phenoxyethyl)piperazine
SMILESCCC1(CC)CNCCN1CCOc1ccccc1
InChIInChI=1S/C16H26N2O/c1-3-16(4-2)14-17-10-11-18(16)12-13-19-15-8-6-5-7-9-15/h5-9,17H,3-4,10-14H2,1-2H3
InChIKeyOPQDVRLSAOOFHL-UHFFFAOYSA-N
XLogP2.53
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-methyl-1-(3-phenoxypropyl)piperazine
CID 64844633
2,2-dimethyl-1-[2-(4-methylphenoxy)ethyl]piperazine
CID 65460395
2-ethyl-2,5-dimethyl-1-(2-phenoxyethyl)piperazine
CID 64845908
2,2,5,5-tetramethyl-1-(2-phenoxyethyl)piperazine
CID 64837993
1-(2,2-dimethylpiperazin-1-yl)-3-phenoxypropan-1-one
CID 65461132
1-(3-phenoxypropyl)piperazine
CID 2760351
2,2-diethyl-1-[3-(2-methoxyethoxy)propyl]piperazine
CID 103414065
2,2,5-trimethyl-1-(2-phenoxyethyl)piperazine
CID 64844519
6-methyl-1-(2-phenoxyethyl)-1,4-diazepane
CID 55017624
4-[2-[(2S)-2-ethyl-2-(hydroxymethyl)pyrrolidin-1-yl]ethoxy]benzonitrile
CID 124621592
2,2-diethyl-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 79261513
1-[2-(2-methoxyphenoxy)ethyl]-1,4-diazaspiro[5.5]undecane;hydrochloride
CID 119933584

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-1-(2-phenoxyethyl)piperazine?
The IUPAC name of 2,2-diethyl-1-(2-phenoxyethyl)piperazine (CID 64846196) is 2,2-diethyl-1-(2-phenoxyethyl)piperazine.
What is the SMILES notation for 2,2-diethyl-1-(2-phenoxyethyl)piperazine?
The canonical SMILES for 2,2-diethyl-1-(2-phenoxyethyl)piperazine is CCC1(CC)CNCCN1CCOc1ccccc1.
What is the InChIKey of 2,2-diethyl-1-(2-phenoxyethyl)piperazine?
The InChIKey is OPQDVRLSAOOFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-16(4-2)14-17-10-11-18(16)12-13-19-15-8-6-5-7-9-15/h5-9,17H,3-4,10-14H2,1-2H3.
What are the key properties of 2,2-diethyl-1-(2-phenoxyethyl)piperazine?
2,2-diethyl-1-(2-phenoxyethyl)piperazine has a molecular weight of 262.40 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-1-(2-phenoxyethyl)piperazine is sourced from PubChem (CID 64846196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).