(2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine

C13H26N2O — CID 165128410

IUPAC(2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine
SMILESCOC[C@H]1CNCCN1CC1CCCCC1
InChIInChI=1S/C13H26N2O/c1-16-11-13-9-14-7-8-15(13)10-12-5-3-2-4-6-12/h12-14H,2-11H2,1H3/t13-/m1/s1
InChIKeyCFJOAEWIKZMILA-CYBMUJFWSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds4

About (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine

(2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine (PubChem CID 165128410) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine.

Molecular Properties

Compound Name(2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine
PubChem CID165128410
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name(2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine
SMILESCOC[C@H]1CNCCN1CC1CCCCC1
InChIInChI=1S/C13H26N2O/c1-16-11-13-9-14-7-8-15(13)10-12-5-3-2-4-6-12/h12-14H,2-11H2,1H3/t13-/m1/s1
InChIKeyCFJOAEWIKZMILA-CYBMUJFWSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine?
The IUPAC name of (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine (CID 165128410) is (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine.
What is the SMILES notation for (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine?
The canonical SMILES for (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine is COC[C@H]1CNCCN1CC1CCCCC1.
What is the InChIKey of (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine?
The InChIKey is CFJOAEWIKZMILA-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H26N2O/c1-16-11-13-9-14-7-8-15(13)10-12-5-3-2-4-6-12/h12-14H,2-11H2,1H3/t13-/m1/s1.
What are the key properties of (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine?
(2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(cyclohexylmethyl)-2-(methoxymethyl)piperazine is sourced from PubChem (CID 165128410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).