(2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine

C17H28N2O3 — CID 95350389

IUPAC(2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine
SMILESCOCCN1CCN(CCOc2ccc(OC)cc2)C[C@H]1C
InChIInChI=1S/C17H28N2O3/c1-15-14-18(8-9-19(15)11-12-20-2)10-13-22-17-6-4-16(21-3)5-7-17/h4-7,15H,8-14H2,1-3H3/t15-/m1/s1
InChIKeyXROXKFAEOUOLIE-OAHLLOKOSA-N
MW308.42 g/mol
LogP1.73
Rot. Bonds8

About (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine

(2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine (PubChem CID 95350389) has the molecular formula C17H28N2O3 and a molecular weight of 308.42 g/mol. Its IUPAC name is (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine
PubChem CID95350389
Molecular FormulaC17H28N2O3
Molecular Weight308.42 g/mol
Exact Mass308.21
IUPAC Name(2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine
SMILESCOCCN1CCN(CCOc2ccc(OC)cc2)C[C@H]1C
InChIInChI=1S/C17H28N2O3/c1-15-14-18(8-9-19(15)11-12-20-2)10-13-22-17-6-4-16(21-3)5-7-17/h4-7,15H,8-14H2,1-3H3/t15-/m1/s1
InChIKeyXROXKFAEOUOLIE-OAHLLOKOSA-N
XLogP1.73
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.42
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-4-[2-(3-chlorophenoxy)ethyl]-1-(2-methoxyethyl)-2-methylpiperazine
CID 95348975
4-[2-(4-ethyl-3-methylpiperazin-1-yl)ethoxy]benzonitrile
CID 63610370
(2R)-1-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperidine
CID 166625466
(2R)-1-(2-ethoxyethyl)-4-[2-(4-methoxyphenyl)ethyl]-2-methylpiperazine
CID 124737287
1-[2-(4-methoxyphenoxy)ethyl]-3-methylpiperidin-4-one
CID 114500510
1-[2-(4-methoxyphenoxy)ethyl]-4-propan-2-ylpiperazine
CID 47010456
[4-[2-(3,4-dimethylpiperazin-1-yl)ethoxy]phenyl]boronic acid
CID 63634672
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
3-(bromomethyl)-1-[2-(4-methoxyphenoxy)ethyl]pyrrolidine
CID 80691311
(2R)-1-(2-ethoxyethyl)-2-methyl-4-[2-(3-methylphenoxy)ethyl]piperazine
CID 124780364
1-[4-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methylpiperazin-1-yl]-3-(4-methoxyphenoxy)propan-2-ol
CID 43001374
(2R)-2-methyl-1-(2-phenoxyethyl)aziridine
CID 122210723

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine?
The IUPAC name of (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine (CID 95350389) is (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine.
What is the SMILES notation for (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine?
The canonical SMILES for (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine is COCCN1CCN(CCOc2ccc(OC)cc2)C[C@H]1C.
What is the InChIKey of (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine?
The InChIKey is XROXKFAEOUOLIE-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H28N2O3/c1-15-14-18(8-9-19(15)11-12-20-2)10-13-22-17-6-4-16(21-3)5-7-17/h4-7,15H,8-14H2,1-3H3/t15-/m1/s1.
What are the key properties of (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine?
(2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine has a molecular weight of 308.42 g/mol, XLogP of 1.73, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-methoxyethyl)-4-[2-(4-methoxyphenoxy)ethyl]-2-methylpiperazine is sourced from PubChem (CID 95350389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).