1-cyclohexyl-2-methylpiperazine;dihydrochloride

C11H24Cl2N2 — CID 53399295

IUPAC1-cyclohexyl-2-methylpiperazine;dihydrochloride
SMILESCC1CNCCN1C1CCCCC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-10-9-12-7-8-13(10)11-5-3-2-4-6-11;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyGBBAGMNWHLYLKX-UHFFFAOYSA-N
MW255.23 g/mol
LogP2.46
Rot. Bonds1

About 1-cyclohexyl-2-methylpiperazine;dihydrochloride

1-cyclohexyl-2-methylpiperazine;dihydrochloride (PubChem CID 53399295) has the molecular formula C11H24Cl2N2 and a molecular weight of 255.23 g/mol. Its IUPAC name is 1-cyclohexyl-2-methylpiperazine;dihydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-2-methylpiperazine;dihydrochloride
PubChem CID53399295
Molecular FormulaC11H24Cl2N2
Molecular Weight255.23 g/mol
Exact Mass254.13
IUPAC Name1-cyclohexyl-2-methylpiperazine;dihydrochloride
SMILESCC1CNCCN1C1CCCCC1.Cl.Cl
InChIInChI=1S/C11H22N2.2ClH/c1-10-9-12-7-8-13(10)11-5-3-2-4-6-11;;/h10-12H,2-9H2,1H3;2*1H
InChIKeyGBBAGMNWHLYLKX-UHFFFAOYSA-N
XLogP2.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-methylpiperazine;dihydrochloride?
The IUPAC name of 1-cyclohexyl-2-methylpiperazine;dihydrochloride (CID 53399295) is 1-cyclohexyl-2-methylpiperazine;dihydrochloride.
What is the SMILES notation for 1-cyclohexyl-2-methylpiperazine;dihydrochloride?
The canonical SMILES for 1-cyclohexyl-2-methylpiperazine;dihydrochloride is CC1CNCCN1C1CCCCC1.Cl.Cl.
What is the InChIKey of 1-cyclohexyl-2-methylpiperazine;dihydrochloride?
The InChIKey is GBBAGMNWHLYLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.2ClH/c1-10-9-12-7-8-13(10)11-5-3-2-4-6-11;;/h10-12H,2-9H2,1H3;2*1H.
What are the key properties of 1-cyclohexyl-2-methylpiperazine;dihydrochloride?
1-cyclohexyl-2-methylpiperazine;dihydrochloride has a molecular weight of 255.23 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-methylpiperazine;dihydrochloride is sourced from PubChem (CID 53399295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).