1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine

C14H30N2 — CID 134441401

IUPAC1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine
SMILESCCN1CCN(CCC(C)(CC)CC)CC1
InChIInChI=1S/C14H30N2/c1-5-14(4,6-2)8-9-16-12-10-15(7-3)11-13-16/h5-13H2,1-4H3
InChIKeyUUXOGCGNGGNGNL-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.84
Rot. Bonds6

About 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine

1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine (PubChem CID 134441401) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine.

Molecular Properties

Compound Name1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine
PubChem CID134441401
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine
SMILESCCN1CCN(CCC(C)(CC)CC)CC1
InChIInChI=1S/C14H30N2/c1-5-14(4,6-2)8-9-16-12-10-15(7-3)11-13-16/h5-13H2,1-4H3
InChIKeyUUXOGCGNGGNGNL-UHFFFAOYSA-N
XLogP2.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-4-(3-ethyl-3-methylpentyl)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

4-(4-ethylpiperazin-1-yl)-2,2-dimethylbutan-1-amine
CID 65249831
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1,4-diethylpiperazine;sulfane
CID 177062456
2-[(4-ethylpiperazin-1-yl)methyl]-2-methyl-N-propylbutan-1-amine
CID 62263159
1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 82084531
4-(4-ethyl-4-methylhexyl)morpholine
CID 134251117
1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine
CID 160568928
ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 170586549
1-(2-cyclopropylethyl)-4-ethylpiperazine
CID 171795940
[4-(3-ethyl-3-methylpentyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 71096247
1-ethyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine
CID 171447106
1-(4-ethylpiperazin-1-yl)-4,4-dimethylpentan-3-one
CID 62625465

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine?
The IUPAC name of 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine (CID 134441401) is 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine.
What is the SMILES notation for 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine?
The canonical SMILES for 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine is CCN1CCN(CCC(C)(CC)CC)CC1.
What is the InChIKey of 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine?
The InChIKey is UUXOGCGNGGNGNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-14(4,6-2)8-9-16-12-10-15(7-3)11-13-16/h5-13H2,1-4H3.
What are the key properties of 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine?
1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine has a molecular weight of 226.41 g/mol, XLogP of 2.84, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(3-ethyl-3-methylpentyl)piperazine is sourced from PubChem (CID 134441401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).