2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid

C15H19NO5 — CID 66434960

IUPAC2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid
SMILESCOc1ccc(CC(=O)N2CCOC(CC(=O)O)C2)cc1
InChIInChI=1S/C15H19NO5/c1-20-12-4-2-11(3-5-12)8-14(17)16-6-7-21-13(10-16)9-15(18)19/h2-5,13H,6-10H2,1H3,(H,18,19)
InChIKeyYRYSEJBTHVLCPJ-UHFFFAOYSA-N
MW293.32 g/mol
LogP0.94
Rot. Bonds5

About 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid

2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid (PubChem CID 66434960) has the molecular formula C15H19NO5 and a molecular weight of 293.32 g/mol. Its IUPAC name is 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid
PubChem CID66434960
Molecular FormulaC15H19NO5
Molecular Weight293.32 g/mol
Exact Mass293.13
IUPAC Name2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid
SMILESCOc1ccc(CC(=O)N2CCOC(CC(=O)O)C2)cc1
InChIInChI=1S/C15H19NO5/c1-20-12-4-2-11(3-5-12)8-14(17)16-6-7-21-13(10-16)9-15(18)19/h2-5,13H,6-10H2,1H3,(H,18,19)
InChIKeyYRYSEJBTHVLCPJ-UHFFFAOYSA-N
XLogP0.94
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[2-(4-ethylphenyl)acetyl]morpholin-2-yl]acetic acid
CID 119248876
2-[4-[2-[4-(2-methylpropoxy)phenyl]acetyl]morpholin-2-yl]acetic acid
CID 119247660
1-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]-2-phenylethanone
CID 46041088
2-[4-[5-(4-methoxyphenyl)-5-oxopentanoyl]morpholin-2-yl]acetic acid
CID 120687850
2-[4-[2-(4-propan-2-ylsulfonylphenyl)acetyl]morpholin-2-yl]acetic acid
CID 120527813
methyl 2-[4-[2-(4-methylphenyl)acetyl]morpholin-2-yl]acetate
CID 79813124
2-[4-[3-(2,5-dimethoxyphenyl)propanoyl]morpholin-2-yl]acetic acid
CID 119248755
2-[4-[3-(3,5-dimethoxyphenyl)propanoyl]morpholin-2-yl]acetic acid
CID 119248324
2-(3,5-dimethoxyphenyl)-1-[2-[(4-methoxyphenoxy)methyl]morpholin-4-yl]ethanone
CID 46100167
2-[4-[2-(2-methylphenyl)acetyl]morpholin-2-yl]acetic acid
CID 66421746
methyl 2-[4-(2-pyridin-4-ylacetyl)morpholin-2-yl]acetate
CID 115535926
2-(4-fluorophenyl)-1-[2-(4-methoxyphenyl)morpholin-4-yl]ethanone
CID 110327189

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid (CID 66434960) is 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid is COc1ccc(CC(=O)N2CCOC(CC(=O)O)C2)cc1.
What is the InChIKey of 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid?
The InChIKey is YRYSEJBTHVLCPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO5/c1-20-12-4-2-11(3-5-12)8-14(17)16-6-7-21-13(10-16)9-15(18)19/h2-5,13H,6-10H2,1H3,(H,18,19).
What are the key properties of 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid?
2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid has a molecular weight of 293.32 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(4-methoxyphenyl)acetyl]morpholin-2-yl]acetic acid is sourced from PubChem (CID 66434960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).