2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride

C15H22ClNO5 — CID 23620383

IUPAC2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride
SMILESCOc1cccc(OCC(=O)OCCN2CCOCC2)c1.Cl
InChIInChI=1S/C15H21NO5.ClH/c1-18-13-3-2-4-14(11-13)21-12-15(17)20-10-7-16-5-8-19-9-6-16;/h2-4,11H,5-10,12H2,1H3;1H
InChIKeyRAMVOKQRSQDBKH-UHFFFAOYSA-N
MW331.80 g/mol
LogP1.37
Rot. Bonds7

About 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride

2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride (PubChem CID 23620383) has the molecular formula C15H22ClNO5 and a molecular weight of 331.80 g/mol. Its IUPAC name is 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride.

Molecular Properties

Compound Name2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride
PubChem CID23620383
Molecular FormulaC15H22ClNO5
Molecular Weight331.80 g/mol
Exact Mass331.12
IUPAC Name2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride
SMILESCOc1cccc(OCC(=O)OCCN2CCOCC2)c1.Cl
InChIInChI=1S/C15H21NO5.ClH/c1-18-13-3-2-4-14(11-13)21-12-15(17)20-10-7-16-5-8-19-9-6-16;/h2-4,11H,5-10,12H2,1H3;1H
InChIKeyRAMVOKQRSQDBKH-UHFFFAOYSA-N
XLogP1.37
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.80
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-morpholin-4-ylethyl 2-(2-methoxyphenoxy)acetate
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3-hydroxy-4-[2-(3-methoxyphenoxy)acetyl]-2-(3-morpholin-4-ylpropyl)-2H-furan-5-one
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CID 170871078
(NE)-N-[1-[3-(2-morpholin-4-ylethoxy)phenyl]ethylidene]hydroxylamine
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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride?
The IUPAC name of 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride (CID 23620383) is 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride.
What is the SMILES notation for 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride?
The canonical SMILES for 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride is COc1cccc(OCC(=O)OCCN2CCOCC2)c1.Cl.
What is the InChIKey of 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride?
The InChIKey is RAMVOKQRSQDBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO5.ClH/c1-18-13-3-2-4-14(11-13)21-12-15(17)20-10-7-16-5-8-19-9-6-16;/h2-4,11H,5-10,12H2,1H3;1H.
What are the key properties of 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride?
2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride has a molecular weight of 331.80 g/mol, XLogP of 1.37, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethyl 2-(3-methoxyphenoxy)acetate;hydrochloride is sourced from PubChem (CID 23620383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).