2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine

C13H28N2 — CID 64931991

IUPAC2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine
SMILESCCCC(C)N1CC(C)(C)NCC1CC
InChIInChI=1S/C13H28N2/c1-6-8-11(3)15-10-13(4,5)14-9-12(15)7-2/h11-12,14H,6-10H2,1-5H3
InChIKeySKDQYALGCVPHPQ-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.64
Rot. Bonds4

About 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine

2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine (PubChem CID 64931991) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine.

Molecular Properties

Compound Name2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine
PubChem CID64931991
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine
SMILESCCCC(C)N1CC(C)(C)NCC1CC
InChIInChI=1S/C13H28N2/c1-6-8-11(3)15-10-13(4,5)14-9-12(15)7-2/h11-12,14H,6-10H2,1-5H3
InChIKeySKDQYALGCVPHPQ-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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

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Related Compounds

8-ethyl-9-pentan-2-yl-6,9-diazaspiro[4.5]decane
CID 64930793
5-cyclopropyl-2-ethyl-5-methyl-1-octan-2-ylpiperazine
CID 64948368
1-[1-(4-chlorophenyl)ethyl]-2-ethyl-5,5-dimethylpiperazine
CID 64948195
1-heptan-2-yl-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64936101
5,5-dimethyl-2-(2-methylpropyl)-1-propan-2-ylpiperazine
CID 64839314
2-ethyl-1-pentan-2-ylpiperazine
CID 64938053
2-ethyl-5,5-dimethyl-1-(1-thiophen-2-ylethyl)piperazine
CID 64934167
8-ethyl-9-octan-2-yl-6,9-diazaspiro[4.5]decane
CID 64946256
2-ethyl-5,5-dimethyl-1-(1-pyridin-2-ylethyl)piperazine
CID 64935510
3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine
CID 64947270
5-cyclopropyl-5-methyl-1-pentan-2-yl-2-propan-2-ylpiperazine
CID 64932384
2-ethyl-1-(2-ethylhexyl)-5,5-dimethylpiperazine
CID 64838710

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine?
The IUPAC name of 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine (CID 64931991) is 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine.
What is the SMILES notation for 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine?
The canonical SMILES for 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine is CCCC(C)N1CC(C)(C)NCC1CC.
What is the InChIKey of 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine?
The InChIKey is SKDQYALGCVPHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-6-8-11(3)15-10-13(4,5)14-9-12(15)7-2/h11-12,14H,6-10H2,1-5H3.
What are the key properties of 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine?
2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine has a molecular weight of 212.38 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine is sourced from PubChem (CID 64931991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).