[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol

C7H15NO2 — CID 155291691

IUPAC[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol
SMILESC[C@H]1CO[C@@H](CO)CN1C
InChIInChI=1S/C7H15NO2/c1-6-5-10-7(4-9)3-8(6)2/h6-7,9H,3-5H2,1-2H3/t6-,7+/m0/s1
InChIKeyIVNWBISDZVPIJJ-NKWVEPMBSA-N
MW145.20 g/mol
LogP-0.30
Rot. Bonds1

About [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol

[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol (PubChem CID 155291691) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol
PubChem CID155291691
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol
SMILESC[C@H]1CO[C@@H](CO)CN1C
InChIInChI=1S/C7H15NO2/c1-6-5-10-7(4-9)3-8(6)2/h6-7,9H,3-5H2,1-2H3/t6-,7+/m0/s1
InChIKeyIVNWBISDZVPIJJ-NKWVEPMBSA-N
XLogP-0.30
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-4,5-dimethylmorpholin-2-yl]methanol
CID 155290710
[(2S,5R)-4,5-dimethylmorpholin-2-yl]methanol
CID 155290635
3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-1-ol
CID 114286796
2-(hydroxymethyl)-5-methylmorpholine-4-carbothioamide
CID 81204075
[5-methyl-4-(3-methylbut-2-enyl)morpholin-2-yl]methanol
CID 81218750
1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-one
CID 81204259
2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]-2-oxoacetic acid
CID 81208191
(2R)-1-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-2-ol
CID 106932860
(5S)-2,4,5-trimethylmorpholine
CID 89376200
(5-methyl-4-propan-2-ylsulfonylmorpholin-2-yl)methanol
CID 81219426
(4-ethanimidoyl-5-methylmorpholin-2-yl)methanol
CID 81212956
[5-methyl-4-(3-methylsulfonylpropyl)morpholin-2-yl]methanol
CID 114286866

Frequently Asked Questions

What is the IUPAC name of [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol?
The IUPAC name of [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol (CID 155291691) is [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol.
What is the SMILES notation for [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol?
The canonical SMILES for [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol is C[C@H]1CO[C@@H](CO)CN1C.
What is the InChIKey of [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol?
The InChIKey is IVNWBISDZVPIJJ-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H15NO2/c1-6-5-10-7(4-9)3-8(6)2/h6-7,9H,3-5H2,1-2H3/t6-,7+/m0/s1.
What are the key properties of [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol?
[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol has a molecular weight of 145.20 g/mol, XLogP of -0.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol is sourced from PubChem (CID 155291691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).