2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine

C16H34N2O — CID 64838014

IUPAC2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine
SMILESCCCC1CN(CCOC(C)C)C(C(C)(C)C)CN1
InChIInChI=1S/C16H34N2O/c1-7-8-14-12-18(9-10-19-13(2)3)15(11-17-14)16(4,5)6/h13-15,17H,7-12H2,1-6H3
InChIKeyCJFURCYXZUZUGH-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.90
Rot. Bonds6

About 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine

2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine (PubChem CID 64838014) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine.

Molecular Properties

Compound Name2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine
PubChem CID64838014
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine
SMILESCCCC1CN(CCOC(C)C)C(C(C)(C)C)CN1
InChIInChI=1S/C16H34N2O/c1-7-8-14-12-18(9-10-19-13(2)3)15(11-17-14)16(4,5)6/h13-15,17H,7-12H2,1-6H3
InChIKeyCJFURCYXZUZUGH-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
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

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Related Compounds

2-tert-butyl-1-(4-methylpentyl)-5-propylpiperazine
CID 83169601
2-tert-butyl-1-(2-methylpropyl)-5-propylpiperazine
CID 64839180
7-methyl-1-(2-propan-2-yloxyethyl)-3-propyl-1,4-diazepane
CID 64871391
5-(2-methylpropyl)-1-(2-propan-2-yloxyethyl)-2-propylpiperazine
CID 64849887
2-tert-butyl-5-(2-methylpropyl)-1-propylpiperazine
CID 64849135
2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine
CID 64838594
2-tert-butyl-1-(3-methylbut-2-enyl)-5-propylpiperazine
CID 114014077
5-ethyl-2-methyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64841710
1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine
CID 64841177
2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine
CID 64841762
2-tert-butyl-1-[2-(1-methylpyrazol-4-yl)ethyl]-5-propylpiperazine
CID 103016292
2-tert-butyl-1-(3-ethoxypropyl)-5-(2-methylpropyl)piperazine
CID 65178297

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine?
The IUPAC name of 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine (CID 64838014) is 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine.
What is the SMILES notation for 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine?
The canonical SMILES for 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine is CCCC1CN(CCOC(C)C)C(C(C)(C)C)CN1.
What is the InChIKey of 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine?
The InChIKey is CJFURCYXZUZUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-7-8-14-12-18(9-10-19-13(2)3)15(11-17-14)16(4,5)6/h13-15,17H,7-12H2,1-6H3.
What are the key properties of 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine?
2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine has a molecular weight of 270.46 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine is sourced from PubChem (CID 64838014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).