[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol

C7H15NO2 — CID 169228660

IUPAC[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol
SMILESC[C@@H]1O[C@@H](CO)CN[C@@H]1C
InChIInChI=1S/C7H15NO2/c1-5-6(2)10-7(4-9)3-8-5/h5-9H,3-4H2,1-2H3/t5-,6+,7-/m1/s1
InChIKeyKPBYWSMHJZUMFN-DSYKOEDSSA-N
MW145.20 g/mol
LogP-0.26
Rot. Bonds1

About [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol

[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol (PubChem CID 169228660) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol
PubChem CID169228660
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol
SMILESC[C@@H]1O[C@@H](CO)CN[C@@H]1C
InChIInChI=1S/C7H15NO2/c1-5-6(2)10-7(4-9)3-8-5/h5-9H,3-4H2,1-2H3/t5-,6+,7-/m1/s1
InChIKeyKPBYWSMHJZUMFN-DSYKOEDSSA-N
XLogP-0.26
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[(2R)-5-methylmorpholin-2-yl]methanol
CID 155273553
(5R)-5-(hydroxymethyl)-1,3-oxazolidine-2-carbaldehyde
CID 174773838
[(2S,5S)-4-bromo-5-methyloxolan-2-yl]methanol
CID 140536422
[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol
CID 12886254
ethane;6-(hydroxymethyl)-2-methyloxane-3,4-diol
CID 143276488
[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol
CID 169228697
[(2S,6R)-6-propan-2-ylmorpholin-2-yl]methanol
CID 169228692
aziridin-2-ylmethanol
CID 11286436
CID 159348131
CID 159348131
[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol
CID 20677770
[(1S,3S,5S)-7-methyl-2,6-dioxabicyclo[3.2.0]heptan-3-yl]methanol
CID 121245668
(2R)-6-(hydroxymethyl)-4-methoxy-2-methyloxan-3-ol
CID 129171598

Frequently Asked Questions

What is the IUPAC name of [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol?
The IUPAC name of [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol (CID 169228660) is [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol.
What is the SMILES notation for [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol?
The canonical SMILES for [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol is C[C@@H]1O[C@@H](CO)CN[C@@H]1C.
What is the InChIKey of [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol?
The InChIKey is KPBYWSMHJZUMFN-DSYKOEDSSA-N. The full InChI is InChI=1S/C7H15NO2/c1-5-6(2)10-7(4-9)3-8-5/h5-9H,3-4H2,1-2H3/t5-,6+,7-/m1/s1.
What are the key properties of [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol?
[(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol has a molecular weight of 145.20 g/mol, XLogP of -0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5R,6S)-5,6-dimethylmorpholin-2-yl]methanol is sourced from PubChem (CID 169228660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).