5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine

C15H30N2 — CID 64947335

IUPAC5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine
SMILESCCC1(C)CN(C2(C)CCCCC2)C(C)CN1
InChIInChI=1S/C15H30N2/c1-5-14(3)12-17(13(2)11-16-14)15(4)9-7-6-8-10-15/h13,16H,5-12H2,1-4H3
InChIKeyAOQDMHCSSJKFEE-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.17
Rot. Bonds2

About 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine

5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine (PubChem CID 64947335) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine.

Molecular Properties

Compound Name5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine
PubChem CID64947335
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine
SMILESCCC1(C)CN(C2(C)CCCCC2)C(C)CN1
InChIInChI=1S/C15H30N2/c1-5-14(3)12-17(13(2)11-16-14)15(4)9-7-6-8-10-15/h13,16H,5-12H2,1-4H3
InChIKeyAOQDMHCSSJKFEE-UHFFFAOYSA-N
XLogP3.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine?
The IUPAC name of 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine (CID 64947335) is 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine.
What is the SMILES notation for 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine?
The canonical SMILES for 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine is CCC1(C)CN(C2(C)CCCCC2)C(C)CN1.
What is the InChIKey of 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine?
The InChIKey is AOQDMHCSSJKFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-14(3)12-17(13(2)11-16-14)15(4)9-7-6-8-10-15/h13,16H,5-12H2,1-4H3.
What are the key properties of 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine?
5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine has a molecular weight of 238.42 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,5-dimethyl-1-(1-methylcyclohexyl)piperazine is sourced from PubChem (CID 64947335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).