(2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine

C15H24N2O — CID 82713741

IUPAC(2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine
SMILESCc1ccc(C)c(OCCN2CCNC[C@H]2C)c1
InChIInChI=1S/C15H24N2O/c1-12-4-5-13(2)15(10-12)18-9-8-17-7-6-16-11-14(17)3/h4-5,10,14,16H,6-9,11H2,1-3H3/t14-/m1/s1
InChIKeyPSIFPUVLXXUMPF-CQSZACIVSA-N
MW248.37 g/mol
LogP1.98
Rot. Bonds4

About (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine

(2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine (PubChem CID 82713741) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine
PubChem CID82713741
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine
SMILESCc1ccc(C)c(OCCN2CCNC[C@H]2C)c1
InChIInChI=1S/C15H24N2O/c1-12-4-5-13(2)15(10-12)18-9-8-17-7-6-16-11-14(17)3/h4-5,10,14,16H,6-9,11H2,1-3H3/t14-/m1/s1
InChIKeyPSIFPUVLXXUMPF-CQSZACIVSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-[2-(2-chloro-4-fluorophenoxy)ethyl]-2-methylpiperazine;hydrochloride
CID 120966667
1-(azetidin-3-yl)-4-[2-(2,5-dimethylphenoxy)ethyl]piperazine
CID 66202000
(2R)-1-[(2,5-dimethylphenyl)methyl]-2-methylpiperazine
CID 82713288
2-(2,5-dimethylphenoxy)-1-(2-methylpiperazin-1-yl)ethanone
CID 119472337
2-methyl-1-[4-(2-methylphenoxy)butyl]-1,4-diazepane
CID 82248528
(2R)-2-methyl-1-[2-(4-nitrophenoxy)ethyl]piperazine
CID 95656887
[1-[2-(2,5-dimethylphenoxy)ethyl]pyrrolidin-2-yl]methanamine;hydrochloride
CID 119927215
(2R)-1-[4-(2-chlorophenoxy)butyl]-2-methylpiperazine
CID 95656879
4-[3-(2,5-dimethylphenoxy)propyl]piperazin-2-one
CID 8548656
1-[2-(2,5-dimethylphenoxy)ethyl]pyrrolidine-3,4-diol
CID 106672249
1-[2-(2,5-dimethylphenoxy)ethyl]pyrrolidine-2-carboxylic acid
CID 43441878
1-[4-(2,5-dimethylphenoxy)butyl]aziridine
CID 125464507

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine?
The IUPAC name of (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine (CID 82713741) is (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine.
What is the SMILES notation for (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine?
The canonical SMILES for (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine is Cc1ccc(C)c(OCCN2CCNC[C@H]2C)c1.
What is the InChIKey of (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine?
The InChIKey is PSIFPUVLXXUMPF-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-4-5-13(2)15(10-12)18-9-8-17-7-6-16-11-14(17)3/h4-5,10,14,16H,6-9,11H2,1-3H3/t14-/m1/s1.
What are the key properties of (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine?
(2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine has a molecular weight of 248.37 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[2-(2,5-dimethylphenoxy)ethyl]-2-methylpiperazine is sourced from PubChem (CID 82713741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).