3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid

C13H17NO4 — CID 117380858

IUPAC3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid
SMILESO=C(O)CCc1cc(N2CCOCC2)ccc1O
InChIInChI=1S/C13H17NO4/c15-12-3-2-11(14-5-7-18-8-6-14)9-10(12)1-4-13(16)17/h2-3,9,15H,1,4-8H2,(H,16,17)
InChIKeyAPZJNXXLCWWZKF-UHFFFAOYSA-N
MW251.28 g/mol
LogP1.25
Rot. Bonds4

About 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid

3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid (PubChem CID 117380858) has the molecular formula C13H17NO4 and a molecular weight of 251.28 g/mol. Its IUPAC name is 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid.

Molecular Properties

Compound Name3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid
PubChem CID117380858
Molecular FormulaC13H17NO4
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC Name3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid
SMILESO=C(O)CCc1cc(N2CCOCC2)ccc1O
InChIInChI=1S/C13H17NO4/c15-12-3-2-11(14-5-7-18-8-6-14)9-10(12)1-4-13(16)17/h2-3,9,15H,1,4-8H2,(H,16,17)
InChIKeyAPZJNXXLCWWZKF-UHFFFAOYSA-N
XLogP1.25
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-methoxy-5-morpholin-4-ylphenyl)propanoic acid
CID 117417021
4-morpholin-4-yl-2-(2-piperazin-1-ylethyl)phenol
CID 117470913
3-(2-methyl-6-morpholin-4-yl-1H-indol-3-yl)propanoic acid
CID 139519298
3-(5-chloro-2-morpholin-4-ylphenyl)propanoic acid
CID 117427366
3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide
CID 46415307
3-(2-hydroxyphenyl)-N-(3-morpholin-4-ylphenyl)propanamide
CID 71938578
2-chloro-5-morpholin-4-ylphenol
CID 84679971
8-(4-morpholin-4-ylphenyl)-8-oxooctanoic acid
CID 68621761
methyl 2-hydroxy-2-(2-hydroxy-5-morpholin-4-ylphenyl)acetate
CID 117421323
3-[4-[(4-morpholin-4-ylphenyl)sulfamoyl]phenyl]propanoic acid
CID 8003799
4-(4-methyl-2-morpholin-4-ylphenyl)butanoic acid
CID 117108460
(3R)-3-amino-4-(4-morpholin-4-ylphenyl)butanoic acid
CID 131873298

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid?
The IUPAC name of 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid (CID 117380858) is 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid.
What is the SMILES notation for 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid?
The canonical SMILES for 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid is O=C(O)CCc1cc(N2CCOCC2)ccc1O.
What is the InChIKey of 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid?
The InChIKey is APZJNXXLCWWZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO4/c15-12-3-2-11(14-5-7-18-8-6-14)9-10(12)1-4-13(16)17/h2-3,9,15H,1,4-8H2,(H,16,17).
What are the key properties of 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid?
3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid has a molecular weight of 251.28 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxy-5-morpholin-4-ylphenyl)propanoic acid is sourced from PubChem (CID 117380858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).