1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine

C16H34N2O — CID 64841177

IUPAC1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine
SMILESCCCCOCCN1CC(CC)NCC1C(C)(C)C
InChIInChI=1S/C16H34N2O/c1-6-8-10-19-11-9-18-13-14(7-2)17-12-15(18)16(3,4)5/h14-15,17H,6-13H2,1-5H3
InChIKeyQVSXXAJIYQHDLN-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.90
Rot. Bonds7

About 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine

1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine (PubChem CID 64841177) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine.

Molecular Properties

Compound Name1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine
PubChem CID64841177
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine
SMILESCCCCOCCN1CC(CC)NCC1C(C)(C)C
InChIInChI=1S/C16H34N2O/c1-6-8-10-19-11-9-18-13-14(7-2)17-12-15(18)16(3,4)5/h14-15,17H,6-13H2,1-5H3
InChIKeyQVSXXAJIYQHDLN-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-tert-butyl-5-ethyl-1-(2-phenoxyethyl)piperazine
CID 64842922
2-tert-butyl-1-(3-ethoxypropyl)-5-(2-methylpropyl)piperazine
CID 65178297
1-(2-butoxyethyl)-2-methyl-5-propylpiperazine
CID 64846186
1-butyl-2-tert-butyl-5-cyclopropylpiperazine
CID 64861474
1-(2-butoxyethyl)-5-tert-butyl-2-propan-2-ylpiperazine
CID 64842412
2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine
CID 64841762
1-(2-butoxyethyl)-2-cyclopropyl-5-propylpiperazine
CID 64839370
2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine
CID 64838014
2-tert-butyl-5-(2-methylpropyl)-1-propylpiperazine
CID 64849135
2-tert-butyl-1-(4-methylpentyl)-5-propylpiperazine
CID 83169601
1-butyl-2-tert-butyl-5-cyclohexylpiperazine
CID 64859625
2-tert-butyl-5-methyl-1-pentylpiperazine
CID 64844984

Frequently Asked Questions

What is the IUPAC name of 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine?
The IUPAC name of 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine (CID 64841177) is 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine.
What is the SMILES notation for 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine?
The canonical SMILES for 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine is CCCCOCCN1CC(CC)NCC1C(C)(C)C.
What is the InChIKey of 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine?
The InChIKey is QVSXXAJIYQHDLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-6-8-10-19-11-9-18-13-14(7-2)17-12-15(18)16(3,4)5/h14-15,17H,6-13H2,1-5H3.
What are the key properties of 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine?
1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine has a molecular weight of 270.46 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine is sourced from PubChem (CID 64841177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).