1-cyclohexyl-4-ethylpiperazine;hydrochloride

C12H25ClN2 — CID 44598236

IUPAC1-cyclohexyl-4-ethylpiperazine;hydrochloride
SMILESCCN1CCN(C2CCCCC2)CC1.Cl
InChIInChI=1S/C12H24N2.ClH/c1-2-13-8-10-14(11-9-13)12-6-4-3-5-7-12;/h12H,2-11H2,1H3;1H
InChIKeyUUPLMXFEGGRZCR-UHFFFAOYSA-N
MW232.80 g/mol
LogP2.38
Rot. Bonds2

About 1-cyclohexyl-4-ethylpiperazine;hydrochloride

1-cyclohexyl-4-ethylpiperazine;hydrochloride (PubChem CID 44598236) has the molecular formula C12H25ClN2 and a molecular weight of 232.80 g/mol. Its IUPAC name is 1-cyclohexyl-4-ethylpiperazine;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-4-ethylpiperazine;hydrochloride
PubChem CID44598236
Molecular FormulaC12H25ClN2
Molecular Weight232.80 g/mol
Exact Mass232.17
IUPAC Name1-cyclohexyl-4-ethylpiperazine;hydrochloride
SMILESCCN1CCN(C2CCCCC2)CC1.Cl
InChIInChI=1S/C12H24N2.ClH/c1-2-13-8-10-14(11-9-13)12-6-4-3-5-7-12;/h12H,2-11H2,1H3;1H
InChIKeyUUPLMXFEGGRZCR-UHFFFAOYSA-N
XLogP2.38
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.80
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-ethylpiperazine;hydrochloride?
The IUPAC name of 1-cyclohexyl-4-ethylpiperazine;hydrochloride (CID 44598236) is 1-cyclohexyl-4-ethylpiperazine;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-4-ethylpiperazine;hydrochloride?
The canonical SMILES for 1-cyclohexyl-4-ethylpiperazine;hydrochloride is CCN1CCN(C2CCCCC2)CC1.Cl.
What is the InChIKey of 1-cyclohexyl-4-ethylpiperazine;hydrochloride?
The InChIKey is UUPLMXFEGGRZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2.ClH/c1-2-13-8-10-14(11-9-13)12-6-4-3-5-7-12;/h12H,2-11H2,1H3;1H.
What are the key properties of 1-cyclohexyl-4-ethylpiperazine;hydrochloride?
1-cyclohexyl-4-ethylpiperazine;hydrochloride has a molecular weight of 232.80 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-ethylpiperazine;hydrochloride is sourced from PubChem (CID 44598236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).