5-ethyl-2,2-dimethyl-1-pentylpiperazine

C13H28N2 — CID 64843523

IUPAC5-ethyl-2,2-dimethyl-1-pentylpiperazine
SMILESCCCCCN1CC(CC)NCC1(C)C
InChIInChI=1S/C13H28N2/c1-5-7-8-9-15-10-12(6-2)14-11-13(15,3)4/h12,14H,5-11H2,1-4H3
InChIKeyYZMHWDMJYDZNON-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.64
Rot. Bonds5

About 5-ethyl-2,2-dimethyl-1-pentylpiperazine

5-ethyl-2,2-dimethyl-1-pentylpiperazine (PubChem CID 64843523) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 5-ethyl-2,2-dimethyl-1-pentylpiperazine.

Molecular Properties

Compound Name5-ethyl-2,2-dimethyl-1-pentylpiperazine
PubChem CID64843523
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name5-ethyl-2,2-dimethyl-1-pentylpiperazine
SMILESCCCCCN1CC(CC)NCC1(C)C
InChIInChI=1S/C13H28N2/c1-5-7-8-9-15-10-12(6-2)14-11-13(15,3)4/h12,14H,5-11H2,1-4H3
InChIKeyYZMHWDMJYDZNON-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,2,5-trimethyl-1-pentylpiperazine
CID 64845904
1-decyl-2,2-dimethyl-5-propan-2-ylpiperazine
CID 64839450
2,2-dimethyl-1-nonyl-5-propan-2-ylpiperazine
CID 64837896
5-ethyl-1-(2-ethylhexyl)-2,2-dimethylpiperazine
CID 64843328
3-ethyl-1-octyl-1,4-diazaspiro[5.5]undecane
CID 64843543
5-cyclohexyl-1-hexyl-2,2-dimethylpiperazine
CID 64861163
1-(2,2-difluoroethyl)-5-ethyl-2,2-dimethylpiperazine
CID 64842161
5-ethyl-2,2-dimethyl-1-(2-methylbutyl)piperazine
CID 64843133
1-butyl-5-cyclohexyl-2,2-dimethylpiperazine
CID 64861711
2,2-diethyl-1-pentyl-5-propylpiperazine
CID 64839985
1-(3,3-dimethylbutyl)-2,2-dimethyl-5-propylpiperazine
CID 64838227
5-ethyl-2,2-dimethyl-1-(2-thiophen-3-ylethyl)piperazine
CID 64841192

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,2-dimethyl-1-pentylpiperazine?
The IUPAC name of 5-ethyl-2,2-dimethyl-1-pentylpiperazine (CID 64843523) is 5-ethyl-2,2-dimethyl-1-pentylpiperazine.
What is the SMILES notation for 5-ethyl-2,2-dimethyl-1-pentylpiperazine?
The canonical SMILES for 5-ethyl-2,2-dimethyl-1-pentylpiperazine is CCCCCN1CC(CC)NCC1(C)C.
What is the InChIKey of 5-ethyl-2,2-dimethyl-1-pentylpiperazine?
The InChIKey is YZMHWDMJYDZNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-7-8-9-15-10-12(6-2)14-11-13(15,3)4/h12,14H,5-11H2,1-4H3.
What are the key properties of 5-ethyl-2,2-dimethyl-1-pentylpiperazine?
5-ethyl-2,2-dimethyl-1-pentylpiperazine has a molecular weight of 212.38 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,2-dimethyl-1-pentylpiperazine is sourced from PubChem (CID 64843523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).