2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid

C14H19NO4 — CID 82091723

IUPAC2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid
SMILESCOc1ccccc1C(CN1CCOCC1)C(=O)O
InChIInChI=1S/C14H19NO4/c1-18-13-5-3-2-4-11(13)12(14(16)17)10-15-6-8-19-9-7-15/h2-5,12H,6-10H2,1H3,(H,16,17)
InChIKeyFWIUAQIBURNKGW-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.20
Rot. Bonds5

About 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid

2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid (PubChem CID 82091723) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid
PubChem CID82091723
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid
SMILESCOc1ccccc1C(CN1CCOCC1)C(=O)O
InChIInChI=1S/C14H19NO4/c1-18-13-5-3-2-4-11(13)12(14(16)17)10-15-6-8-19-9-7-15/h2-5,12H,6-10H2,1H3,(H,16,17)
InChIKeyFWIUAQIBURNKGW-UHFFFAOYSA-N
XLogP1.20
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenyl)-3-morpholin-4-ylpropanenitrile
CID 82086146
methyl 2-(2-fluorophenyl)-3-morpholin-4-ylpropanoate
CID 117244261
3-[4-(2-methoxyphenyl)piperidin-1-yl]-2-phenylpropanoic acid
CID 56993017
2-(2-methoxyphenoxy)-N-(2-morpholin-4-yl-1-phenylethyl)acetamide
CID 18103834
2-(4-bromophenyl)-3-morpholin-4-ylpropanoic acid
CID 82095248
1-(4-ethoxyphenyl)-3-morpholin-4-yl-2-phenylpropan-1-one chloride
CID 53347221
3-(2-methoxyphenoxy)-2-(2-methoxyphenyl)propanoic acid
CID 117244346
3-(azepan-1-yl)-2-(2-methylphenyl)propanoic acid
CID 117244237
1-(2-methoxy-4,5-dimethylphenyl)-2-morpholin-4-ylethanol
CID 82122625
1-(2,5-dimethoxyphenyl)-2-morpholin-4-ylethanamine
CID 16780959
ethyl 3-(2-methoxyphenyl)-3-morpholin-4-ylpropanoate
CID 64528220
2-(4-methoxyphenyl)-3-[2-(2-morpholin-4-ylethoxy)phenyl]propanoic acid
CID 20993638

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid?
The IUPAC name of 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid (CID 82091723) is 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid.
What is the SMILES notation for 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid?
The canonical SMILES for 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid is COc1ccccc1C(CN1CCOCC1)C(=O)O.
What is the InChIKey of 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid?
The InChIKey is FWIUAQIBURNKGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4/c1-18-13-5-3-2-4-11(13)12(14(16)17)10-15-6-8-19-9-7-15/h2-5,12H,6-10H2,1H3,(H,16,17).
What are the key properties of 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid?
2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid has a molecular weight of 265.31 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-3-morpholin-4-ylpropanoic acid is sourced from PubChem (CID 82091723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).