5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine

C14H30N2 — CID 64862336

IUPAC5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine
SMILESCCC1(CC)CN(CCC(C)C)C(C)CN1
InChIInChI=1S/C14H30N2/c1-6-14(7-2)11-16(9-8-12(3)4)13(5)10-15-14/h12-13,15H,6-11H2,1-5H3
InChIKeyUIRLFFMDUVWCQW-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds5

About 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine

5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine (PubChem CID 64862336) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine.

Molecular Properties

Compound Name5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine
PubChem CID64862336
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine
SMILESCCC1(CC)CN(CCC(C)C)C(C)CN1
InChIInChI=1S/C14H30N2/c1-6-14(7-2)11-16(9-8-12(3)4)13(5)10-15-14/h12-13,15H,6-11H2,1-5H3
InChIKeyUIRLFFMDUVWCQW-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine
CID 64861980
1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine
CID 114201402
5,5-diethyl-2-methyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64860416
5,5-diethyl-2-methyl-1-(2-methylsulfonylethyl)piperazine
CID 64860997
5,5-diethyl-1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103414386
5,5-diethyl-2-methyl-1-(3-phenylpropyl)piperazine
CID 64861186
2-[(5,5-diethyl-2-methylpiperazin-1-yl)methyl]-4-methylmorpholine
CID 79078121
5-cyclopropyl-2,5-dimethyl-1-(5-methylhexyl)piperazine
CID 113287832
2,5,5-trimethyl-1-[2-(3-methylbutoxy)ethyl]piperazine
CID 64839085
3,3-diethyl-1-(3-methylbutyl)piperazine
CID 64833456
5,5-diethyl-2-methyl-1-[2-(2-methylpyrazol-3-yl)ethyl]piperazine
CID 103016611
1-benzyl-5,5-diethyl-2-methylpiperazine
CID 64862341

Frequently Asked Questions

What is the IUPAC name of 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine?
The IUPAC name of 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine (CID 64862336) is 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine.
What is the SMILES notation for 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine?
The canonical SMILES for 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine is CCC1(CC)CN(CCC(C)C)C(C)CN1.
What is the InChIKey of 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine?
The InChIKey is UIRLFFMDUVWCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-6-14(7-2)11-16(9-8-12(3)4)13(5)10-15-14/h12-13,15H,6-11H2,1-5H3.
What are the key properties of 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine?
5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine is sourced from PubChem (CID 64862336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).