2-[(3R)-morpholin-3-yl]-1-phenylethanone

C12H15NO2 — CID 95396636

IUPAC2-[(3R)-morpholin-3-yl]-1-phenylethanone
SMILESO=C(C[C@@H]1COCCN1)c1ccccc1
InChIInChI=1S/C12H15NO2/c14-12(10-4-2-1-3-5-10)8-11-9-15-7-6-13-11/h1-5,11,13H,6-9H2/t11-/m1/s1
InChIKeyXHVLUTQIIVXHCI-LLVKDONJSA-N
MW205.26 g/mol
LogP1.25
Rot. Bonds3

About 2-[(3R)-morpholin-3-yl]-1-phenylethanone

2-[(3R)-morpholin-3-yl]-1-phenylethanone (PubChem CID 95396636) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-[(3R)-morpholin-3-yl]-1-phenylethanone.

Molecular Properties

Compound Name2-[(3R)-morpholin-3-yl]-1-phenylethanone
PubChem CID95396636
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name2-[(3R)-morpholin-3-yl]-1-phenylethanone
SMILESO=C(C[C@@H]1COCCN1)c1ccccc1
InChIInChI=1S/C12H15NO2/c14-12(10-4-2-1-3-5-10)8-11-9-15-7-6-13-11/h1-5,11,13H,6-9H2/t11-/m1/s1
InChIKeyXHVLUTQIIVXHCI-LLVKDONJSA-N
XLogP1.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Alanine, 3-benzoyl-N-(2-hydroxyethyl)-, ethyl ester, hydrochloride
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3-Morpholino-1-phenylpropan-1-one
CID 408261
3-Morpholin-4-yl-1-phenylpropane-1,2-dione
CID 162671134
2-Piperidyl-acetophenone
CID 93513730
1-Phenyl-2-(piperidin-2-YL)ethan-1-one
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(4R,5R)-5-methyl-4-phenacyl-1,3-oxazolidin-2-one
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2-[(tert-Butylamino)methyl]-3-(morpholin-4-yl)-1-phenylpropan-1-one
CID 336395
2-(Morpholin-3-yl)-1-phenylethan-1-one hydrochloride
CID 54595500
rac-(3R,4R)-4-benzoyloxolan-3-amine hydrochloride
CID 167994849

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-morpholin-3-yl]-1-phenylethanone?
The IUPAC name of 2-[(3R)-morpholin-3-yl]-1-phenylethanone (CID 95396636) is 2-[(3R)-morpholin-3-yl]-1-phenylethanone.
What is the SMILES notation for 2-[(3R)-morpholin-3-yl]-1-phenylethanone?
The canonical SMILES for 2-[(3R)-morpholin-3-yl]-1-phenylethanone is O=C(C[C@@H]1COCCN1)c1ccccc1.
What is the InChIKey of 2-[(3R)-morpholin-3-yl]-1-phenylethanone?
The InChIKey is XHVLUTQIIVXHCI-LLVKDONJSA-N. The full InChI is InChI=1S/C12H15NO2/c14-12(10-4-2-1-3-5-10)8-11-9-15-7-6-13-11/h1-5,11,13H,6-9H2/t11-/m1/s1.
What are the key properties of 2-[(3R)-morpholin-3-yl]-1-phenylethanone?
2-[(3R)-morpholin-3-yl]-1-phenylethanone has a molecular weight of 205.26 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-morpholin-3-yl]-1-phenylethanone is sourced from PubChem (CID 95396636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).