(2R)-2-methylmorpholin-3-one

C5H9NO2 — CID 13440629

IUPAC(2R)-2-methylmorpholin-3-one
SMILESC[C@H]1OCCNC1=O
InChIInChI=1S/C5H9NO2/c1-4-5(7)6-2-3-8-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m1/s1
InChIKeyLEGKNUIZNFTVBI-SCSAIBSYSA-N
MW115.13 g/mol
LogP-0.48
Rot. Bonds

About (2R)-2-methylmorpholin-3-one

(2R)-2-methylmorpholin-3-one (PubChem CID 13440629) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is (2R)-2-methylmorpholin-3-one.

Molecular Properties

Compound Name(2R)-2-methylmorpholin-3-one
PubChem CID13440629
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name(2R)-2-methylmorpholin-3-one
SMILESC[C@H]1OCCNC1=O
InChIInChI=1S/C5H9NO2/c1-4-5(7)6-2-3-8-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m1/s1
InChIKeyLEGKNUIZNFTVBI-SCSAIBSYSA-N
XLogP-0.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,6-Dimethylmorpholine-2,3-dione
CID 3469206
3-Morpholinone
CID 66953
Morpholine-2-carboxamide
CID 15955786
(5R)-5-methylmorpholin-3-one
CID 12400352
(5S)-5-Methylmorpholin-3-one
CID 12400353
(6R)-6-methylmorpholin-3-one
CID 54310878
(6S)-6-methylmorpholin-3-one
CID 57516786
(2S,5S)-2,5-dimethylmorpholin-3-one
CID 55303247
2,6-Dimethylmorpholin-3-one
CID 14243216
N-Ethyl-2-(4-piperidinyloxy)acetamide
CID 20298099
N-Methylmorpholine-2-carboxamide
CID 20377550
6-(Aminomethyl)morpholin-3-one hydrochloride
CID 22612261

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methylmorpholin-3-one?
The IUPAC name of (2R)-2-methylmorpholin-3-one (CID 13440629) is (2R)-2-methylmorpholin-3-one.
What is the SMILES notation for (2R)-2-methylmorpholin-3-one?
The canonical SMILES for (2R)-2-methylmorpholin-3-one is C[C@H]1OCCNC1=O.
What is the InChIKey of (2R)-2-methylmorpholin-3-one?
The InChIKey is LEGKNUIZNFTVBI-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9NO2/c1-4-5(7)6-2-3-8-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m1/s1.
What are the key properties of (2R)-2-methylmorpholin-3-one?
(2R)-2-methylmorpholin-3-one has a molecular weight of 115.13 g/mol, XLogP of -0.48, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methylmorpholin-3-one is sourced from PubChem (CID 13440629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).