[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate

C9H17NO4 — CID 71177850

IUPAC[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate
SMILESCC(=O)OC[C@@H](O)CN1CCOCC1
InChIInChI=1S/C9H17NO4/c1-8(11)14-7-9(12)6-10-2-4-13-5-3-10/h9,12H,2-7H2,1H3/t9-/m0/s1
InChIKeyRLDIHYQYIYJARP-VIFPVBQESA-N
MW203.24 g/mol
LogP-0.76
Rot. Bonds4

About [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate

[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate (PubChem CID 71177850) has the molecular formula C9H17NO4 and a molecular weight of 203.24 g/mol. Its IUPAC name is [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate.

Molecular Properties

Compound Name[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate
PubChem CID71177850
Molecular FormulaC9H17NO4
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC Name[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate
SMILESCC(=O)OC[C@@H](O)CN1CCOCC1
InChIInChI=1S/C9H17NO4/c1-8(11)14-7-9(12)6-10-2-4-13-5-3-10/h9,12H,2-7H2,1H3/t9-/m0/s1
InChIKeyRLDIHYQYIYJARP-VIFPVBQESA-N
XLogP-0.76
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-0.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate 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

(3R)-3-hydroxy-4-morpholin-4-ylbutanamide
CID 69066222
(2-amino-3-morpholin-4-yl-3-oxopropyl) acetate
CID 11436688
ethyl 4-(2-hydroxy-3-morpholin-4-ylpropyl)piperazine-1-carboxylate
CID 56827922
3-hydroxy-4-morpholin-4-ylbutanoic acid
CID 79006775
ethyl acetate;4-propylmorpholine
CID 160534633
(2-hydroxy-3-morpholin-4-ylpropyl) pyrimidine-5-carboxylate
CID 141018164
tert-butyl 4-hydroxy-2-methyl-5-morpholin-4-ylpentanoate
CID 121437761
1-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-2-ol
CID 129310449
[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] 2-(1-adamantyl)acetate
CID 7336055
(2S)-3-morpholin-4-ylpropane-1,2-diol
CID 1268043
1-[4-[(2R)-2-hydroxy-3-morpholin-4-ylpropoxy]phenyl]propan-1-one
CID 977024
ethyl 2-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]acetate
CID 60681827

Frequently Asked Questions

What is the IUPAC name of [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate?
The IUPAC name of [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate (CID 71177850) is [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate.
What is the SMILES notation for [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate?
The canonical SMILES for [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate is CC(=O)OC[C@@H](O)CN1CCOCC1.
What is the InChIKey of [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate?
The InChIKey is RLDIHYQYIYJARP-VIFPVBQESA-N. The full InChI is InChI=1S/C9H17NO4/c1-8(11)14-7-9(12)6-10-2-4-13-5-3-10/h9,12H,2-7H2,1H3/t9-/m0/s1.
What are the key properties of [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate?
[(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate has a molecular weight of 203.24 g/mol, XLogP of -0.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-hydroxy-3-morpholin-4-ylpropyl] acetate is sourced from PubChem (CID 71177850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).