1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine

C14H30N2 — CID 103465293

IUPAC1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine
SMILESCCC(C)(C)CN1CC(C)(CC)NCC1C
InChIInChI=1S/C14H30N2/c1-7-13(4,5)10-16-11-14(6,8-2)15-9-12(16)3/h12,15H,7-11H2,1-6H3
InChIKeyQDIJSYKFBJLTEP-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds4

About 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine

1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine (PubChem CID 103465293) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine.

Molecular Properties

Compound Name1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine
PubChem CID103465293
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine
SMILESCCC(C)(C)CN1CC(C)(CC)NCC1C
InChIInChI=1S/C14H30N2/c1-7-13(4,5)10-16-11-14(6,8-2)15-9-12(16)3/h12,15H,7-11H2,1-6H3
InChIKeyQDIJSYKFBJLTEP-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine 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

5-ethyl-2,5-dimethyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 112592085
1-butyl-5-ethyl-2,5-dimethylpiperazine
CID 64849431
5-ethyl-1-(3-methoxy-3-methylbutyl)-2,5-dimethylpiperazine
CID 103016503
1-(cyclohexylmethyl)-5-ethyl-2,5-dimethylpiperazine
CID 64847892
1-[2-(4-chlorophenyl)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 64934390
5-ethyl-2,5-dimethyl-1-(2-propan-2-yloxyethyl)piperazine
CID 64847117
5-ethyl-2,5-dimethyl-1-[(2-methyloxolan-3-yl)methyl]piperazine
CID 114106372
5-ethyl-2,5-dimethyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine
CID 79350282
1-[2-(2,2-difluoroethoxy)ethyl]-5-ethyl-2,5-dimethylpiperazine
CID 114127962
5-[2-(5-ethyl-2,5-dimethylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole
CID 106408830
4-[(5-ethyl-2,5-dimethylpiperazin-1-yl)methyl]-3,5-dimethyl-1,2-oxazole
CID 79238559
2-tert-butyl-5-ethyl-5-methyl-1-prop-2-enylpiperazine
CID 64848908

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine?
The IUPAC name of 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine (CID 103465293) is 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine.
What is the SMILES notation for 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine?
The canonical SMILES for 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine is CCC(C)(C)CN1CC(C)(CC)NCC1C.
What is the InChIKey of 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine?
The InChIKey is QDIJSYKFBJLTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-7-13(4,5)10-16-11-14(6,8-2)15-9-12(16)3/h12,15H,7-11H2,1-6H3.
What are the key properties of 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine?
1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylbutyl)-5-ethyl-2,5-dimethylpiperazine is sourced from PubChem (CID 103465293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).