2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine

C16H34N2 — CID 64841762

IUPAC2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine
SMILESCCCC(C)CN1CC(CC)NCC1C(C)(C)C
InChIInChI=1S/C16H34N2/c1-7-9-13(3)11-18-12-14(8-2)17-10-15(18)16(4,5)6/h13-15,17H,7-12H2,1-6H3
InChIKeyFQZTWHGULUZBGH-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds5

About 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine

2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine (PubChem CID 64841762) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine.

Molecular Properties

Compound Name2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine
PubChem CID64841762
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine
SMILESCCCC(C)CN1CC(CC)NCC1C(C)(C)C
InChIInChI=1S/C16H34N2/c1-7-9-13(3)11-18-12-14(8-2)17-10-15(18)16(4,5)6/h13-15,17H,7-12H2,1-6H3
InChIKeyFQZTWHGULUZBGH-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-tert-butyl-1-(2-methylpropyl)-5-propylpiperazine
CID 64839180
2-tert-butyl-5-(2-methylpropyl)-1-propylpiperazine
CID 64849135
2-tert-butyl-1-(4-methylpentyl)-5-propylpiperazine
CID 83169601
1-(2-butoxyethyl)-2-tert-butyl-5-ethylpiperazine
CID 64841177
2-tert-butyl-1-(2-propan-2-yloxyethyl)-5-propylpiperazine
CID 64838014
2-tert-butyl-1-(cyclopropylmethyl)-5-propylpiperazine
CID 64838594
2-tert-butyl-1-(3-methylbut-2-enyl)-5-propylpiperazine
CID 114014077
2-tert-butyl-5-methyl-1-(2-methylpropyl)piperazine
CID 64844981
1-[(4-bromophenyl)methyl]-2-tert-butyl-5-ethylpiperazine
CID 64843504
3-tert-butyl-7-methyl-1-(2-methylpentyl)-1,4-diazepane
CID 64870421
2-tert-butyl-5-ethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64842153
2-tert-butyl-5-ethyl-1-(2-phenoxyethyl)piperazine
CID 64842922

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine?
The IUPAC name of 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine (CID 64841762) is 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine.
What is the SMILES notation for 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine?
The canonical SMILES for 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine is CCCC(C)CN1CC(CC)NCC1C(C)(C)C.
What is the InChIKey of 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine?
The InChIKey is FQZTWHGULUZBGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-7-9-13(3)11-18-12-14(8-2)17-10-15(18)16(4,5)6/h13-15,17H,7-12H2,1-6H3.
What are the key properties of 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine?
2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-ethyl-1-(2-methylpentyl)piperazine is sourced from PubChem (CID 64841762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).