1-(cyclohexylmethyl)piperazine;dihydrochloride

C11H24Cl2N2 — CID 22120190

IUPAC1-(cyclohexylmethyl)piperazine;dihydrochloride
SMILESC1CCC(CN2CCNCC2)CC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;;/h11-12H,1-10H2;2*1H
InChIKeyVBHDFWIQTUHYEL-UHFFFAOYSA-N
MW255.23 g/mol
LogP2.32
Rot. Bonds2

About 1-(cyclohexylmethyl)piperazine;dihydrochloride

1-(cyclohexylmethyl)piperazine;dihydrochloride (PubChem CID 22120190) has the molecular formula C11H24Cl2N2 and a molecular weight of 255.23 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)piperazine;dihydrochloride.

Molecular Properties

Compound Name1-(cyclohexylmethyl)piperazine;dihydrochloride
PubChem CID22120190
Molecular FormulaC11H24Cl2N2
Molecular Weight255.23 g/mol
Exact Mass254.13
IUPAC Name1-(cyclohexylmethyl)piperazine;dihydrochloride
SMILESC1CCC(CN2CCNCC2)CC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;;/h11-12H,1-10H2;2*1H
InChIKeyVBHDFWIQTUHYEL-UHFFFAOYSA-N
XLogP2.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)piperazine;dihydrochloride?
The IUPAC name of 1-(cyclohexylmethyl)piperazine;dihydrochloride (CID 22120190) is 1-(cyclohexylmethyl)piperazine;dihydrochloride.
What is the SMILES notation for 1-(cyclohexylmethyl)piperazine;dihydrochloride?
The canonical SMILES for 1-(cyclohexylmethyl)piperazine;dihydrochloride is C1CCC(CN2CCNCC2)CC1.Cl.Cl.
What is the InChIKey of 1-(cyclohexylmethyl)piperazine;dihydrochloride?
The InChIKey is VBHDFWIQTUHYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.2ClH/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13;;/h11-12H,1-10H2;2*1H.
What are the key properties of 1-(cyclohexylmethyl)piperazine;dihydrochloride?
1-(cyclohexylmethyl)piperazine;dihydrochloride has a molecular weight of 255.23 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)piperazine;dihydrochloride is sourced from PubChem (CID 22120190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).