(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate

C14H20N2O4 — CID 79183171

IUPAC(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate
SMILESCN1CCOC(COC(=O)COc2ccccc2N)C1
InChIInChI=1S/C14H20N2O4/c1-16-6-7-18-11(8-16)9-20-14(17)10-19-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3
InChIKeyQFIHEJHTOBQXEL-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.52
Rot. Bonds5

About (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate

(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate (PubChem CID 79183171) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate.

Molecular Properties

Compound Name(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate
PubChem CID79183171
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate
SMILESCN1CCOC(COC(=O)COc2ccccc2N)C1
InChIInChI=1S/C14H20N2O4/c1-16-6-7-18-11(8-16)9-20-14(17)10-19-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3
InChIKeyQFIHEJHTOBQXEL-UHFFFAOYSA-N
XLogP0.52
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-(2-aminophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
CID 79079684
cyclohexylmethyl 2-(2-aminophenoxy)acetate
CID 61321591
[2-[(4-methylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166937
2-methyl-6-[(4-methylmorpholin-2-yl)methoxy]aniline
CID 79165775
(4-methylmorpholin-2-yl)methyl 4-amino-3-methylbenzoate
CID 79182728
3-(oxolan-2-yl)propyl 2-(2-aminophenoxy)acetate
CID 65166038
(4-propan-2-ylmorpholin-2-yl)methyl 2-(2-aminophenyl)acetate
CID 64532957
2-[2-(2-ethylmorpholin-4-yl)ethoxy]aniline
CID 43562249
4-methyl-2-[(2-methyl-3-pyridinyl)oxymethyl]morpholine
CID 70907046
(4-methylmorpholin-2-yl)methyl 2-(3-aminophenyl)propanoate
CID 106592454
2-(2-methoxyphenoxy)-N-[2-(4-methylmorpholin-2-yl)ethyl]acetamide
CID 110709914
2-(2-aminophenoxy)-N-[(1-methylpyrrolidin-3-yl)methyl]acetamide
CID 60855037

Frequently Asked Questions

What is the IUPAC name of (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate?
The IUPAC name of (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate (CID 79183171) is (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate.
What is the SMILES notation for (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate?
The canonical SMILES for (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate is CN1CCOC(COC(=O)COc2ccccc2N)C1.
What is the InChIKey of (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate?
The InChIKey is QFIHEJHTOBQXEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-16-6-7-18-11(8-16)9-20-14(17)10-19-13-5-3-2-4-12(13)15/h2-5,11H,6-10,15H2,1H3.
What are the key properties of (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate?
(4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate has a molecular weight of 280.32 g/mol, XLogP of 0.52, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylmorpholin-2-yl)methyl 2-(2-aminophenoxy)acetate is sourced from PubChem (CID 79183171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).