(2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid

C9H16N2O5 — CID 80751146

IUPAC(2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid
SMILESO=C(CC1COCCN1)N[C@H](CO)C(=O)O
InChIInChI=1S/C9H16N2O5/c12-4-7(9(14)15)11-8(13)3-6-5-16-2-1-10-6/h6-7,10,12H,1-5H2,(H,11,13)(H,14,15)/t6?,7-/m1/s1
InChIKeyWIXHKDYTJQABDT-COBSHVIPSA-N
MW232.24 g/mol
LogP-2.07
Rot. Bonds5

About (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid

(2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid (PubChem CID 80751146) has the molecular formula C9H16N2O5 and a molecular weight of 232.24 g/mol. Its IUPAC name is (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid.

Molecular Properties

Compound Name(2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid
PubChem CID80751146
Molecular FormulaC9H16N2O5
Molecular Weight232.24 g/mol
Exact Mass232.11
IUPAC Name(2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid
SMILESO=C(CC1COCCN1)N[C@H](CO)C(=O)O
InChIInChI=1S/C9H16N2O5/c12-4-7(9(14)15)11-8(13)3-6-5-16-2-1-10-6/h6-7,10,12H,1-5H2,(H,11,13)(H,14,15)/t6?,7-/m1/s1
InChIKeyWIXHKDYTJQABDT-COBSHVIPSA-N
XLogP-2.07
TPSA107.89 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 5-2.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-3-hydroxy-2-(morpholine-3-carbonylamino)propanoic acid
CID 80750560
2-[[2-(1,1-dioxo-1,4-thiazinan-3-yl)acetyl]amino]-3-hydroxypropanoic acid
CID 80520223
2-morpholin-3-ylacetic acid;hydrochloride
CID 13099576
2-morpholin-3-yl-N-octan-4-ylacetamide
CID 114138382
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-morpholin-3-ylacetamide
CID 81349518
3-hydroxy-2-[(2-piperidin-4-ylacetyl)amino]propanoic acid
CID 61157563
2-methyl-3-morpholin-3-ylpropanoic acid;hydrochloride
CID 90043742
2-[(3S)-morpholin-3-yl]acetamide
CID 96824646
(2R)-3-hydroxy-2-[(2-pyrrolidin-3-ylacetyl)amino]propanoic acid
CID 80750139
N-(2-methylprop-2-enyl)-2-morpholin-3-ylacetamide
CID 114617037
N-(2-amino-2-oxoethoxy)-2-morpholin-3-ylacetamide
CID 112674067
N-(3,3-diphenylpropyl)-2-[(3S)-morpholin-3-yl]acetamide
CID 95723724

Frequently Asked Questions

What is the IUPAC name of (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid?
The IUPAC name of (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid (CID 80751146) is (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid.
What is the SMILES notation for (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid?
The canonical SMILES for (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid is O=C(CC1COCCN1)N[C@H](CO)C(=O)O.
What is the InChIKey of (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid?
The InChIKey is WIXHKDYTJQABDT-COBSHVIPSA-N. The full InChI is InChI=1S/C9H16N2O5/c12-4-7(9(14)15)11-8(13)3-6-5-16-2-1-10-6/h6-7,10,12H,1-5H2,(H,11,13)(H,14,15)/t6?,7-/m1/s1.
What are the key properties of (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid?
(2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid has a molecular weight of 232.24 g/mol, XLogP of -2.07, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-3-hydroxy-2-[(2-morpholin-3-ylacetyl)amino]propanoic acid is sourced from PubChem (CID 80751146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).