1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine

C18H36N2 — CID 79878235

IUPAC1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine
SMILESCCC1CNC(CC(C)C)CN1C1CCCCC1(C)C
InChIInChI=1S/C18H36N2/c1-6-16-12-19-15(11-14(2)3)13-20(16)17-9-7-8-10-18(17,4)5/h14-17,19H,6-13H2,1-5H3
InChIKeySATNVRIVJMSCQM-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.05
Rot. Bonds4

About 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine

1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine (PubChem CID 79878235) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine
PubChem CID79878235
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine
SMILESCCC1CNC(CC(C)C)CN1C1CCCCC1(C)C
InChIInChI=1S/C18H36N2/c1-6-16-12-19-15(11-14(2)3)13-20(16)17-9-7-8-10-18(17,4)5/h14-17,19H,6-13H2,1-5H3
InChIKeySATNVRIVJMSCQM-UHFFFAOYSA-N
XLogP4.05
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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

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Related Compounds

1-cyclooctyl-2-ethyl-5-(2-methylpropyl)piperazine
CID 64931371
2-ethyl-5-(2-methylpropyl)-1-(2,2,3,3-tetramethylcyclopropyl)piperazine
CID 79351246
5-cyclopropyl-1-(2,2-dimethylcyclopentyl)-2-ethylpiperazine
CID 79878064
1-(1-cyclohexylpropyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 64941532
1-(2-cyclopentylethyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 64934770
1-(2,2-dimethylcyclopentyl)-5-ethyl-2-phenylpiperazine
CID 79871083
2-ethyl-1-(2-ethylbutyl)-5-(2-methylpropyl)piperazine
CID 82925413
1-(2,3-dimethylbutyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 64941869
2-cyclohexyl-1-cyclopentyl-5-(2-methylpropyl)piperazine
CID 82925572
2-ethyl-1-(5-methylhexyl)-5-(2-methylpropyl)piperazine
CID 115327036
2-cyclopropyl-1-hexyl-2-methyl-5-(2-methylpropyl)piperazine
CID 64849739
5-butan-2-yl-1-(2,2-dimethylcyclopentyl)-2-methylpiperazine
CID 79878573

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine?
The IUPAC name of 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine (CID 79878235) is 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine?
The canonical SMILES for 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine is CCC1CNC(CC(C)C)CN1C1CCCCC1(C)C.
What is the InChIKey of 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine?
The InChIKey is SATNVRIVJMSCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-6-16-12-19-15(11-14(2)3)13-20(16)17-9-7-8-10-18(17,4)5/h14-17,19H,6-13H2,1-5H3.
What are the key properties of 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine?
1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine has a molecular weight of 280.50 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclohexyl)-2-ethyl-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 79878235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).