5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine

C18H36N2 — CID 64948153

IUPAC5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine
SMILESCCC1CCC(N2CC(C(C)(C)C)NCC2CC)CC1
InChIInChI=1S/C18H36N2/c1-6-14-8-10-16(11-9-14)20-13-17(18(3,4)5)19-12-15(20)7-2/h14-17,19H,6-13H2,1-5H3
InChIKeyJYLUUXZVUZHLNS-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.05
Rot. Bonds3

About 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine

5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine (PubChem CID 64948153) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine.

Molecular Properties

Compound Name5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine
PubChem CID64948153
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine
SMILESCCC1CCC(N2CC(C(C)(C)C)NCC2CC)CC1
InChIInChI=1S/C18H36N2/c1-6-14-8-10-16(11-9-14)20-13-17(18(3,4)5)19-12-15(20)7-2/h14-17,19H,6-13H2,1-5H3
InChIKeyJYLUUXZVUZHLNS-UHFFFAOYSA-N
XLogP4.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)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-(5-tert-butyl-2-ethylpiperazin-1-yl)thiane 1,1-dioxide
CID 64935035
5-tert-butyl-1-(4,4-dimethylcyclohexyl)-2-ethylpiperazine
CID 64941461
3-(5-tert-butyl-2-ethylpiperazin-1-yl)thiolane 1,1-dioxide
CID 64932588
5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine
CID 64947348
5-tert-butyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine
CID 82737366
2-ethyl-5-methyl-1-(4-methylcyclohexyl)piperazine
CID 64954867
5-tert-butyl-2-ethyl-1-(1-methoxybutan-2-yl)piperazine
CID 64940687
5-tert-butyl-2-ethyl-1-(oxolan-3-ylmethyl)piperazine
CID 64843761
2,5-ditert-butyl-1-cyclohexylpiperazine
CID 82937382
5-tert-butyl-1-(cyclohex-3-en-1-ylmethyl)-2-ethylpiperazine
CID 64946001
5-tert-butyl-2-ethyl-1-hex-5-yn-3-ylpiperazine
CID 113478280
5-tert-butyl-1-(2,3-dihydro-1-benzofuran-3-yl)-2-ethylpiperazine
CID 64941260

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine?
The IUPAC name of 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine (CID 64948153) is 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine.
What is the SMILES notation for 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine?
The canonical SMILES for 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine is CCC1CCC(N2CC(C(C)(C)C)NCC2CC)CC1.
What is the InChIKey of 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine?
The InChIKey is JYLUUXZVUZHLNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-6-14-8-10-16(11-9-14)20-13-17(18(3,4)5)19-12-15(20)7-2/h14-17,19H,6-13H2,1-5H3.
What are the key properties of 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine?
5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine has a molecular weight of 280.50 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine is sourced from PubChem (CID 64948153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).