[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol

C7H15NO3 — CID 20677770

IUPAC[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol
SMILESCN1CC(CO)OC(CO)C1
InChIInChI=1S/C7H15NO3/c1-8-2-6(4-9)11-7(3-8)5-10/h6-7,9-10H,2-5H2,1H3
InChIKeyXKAAYFXKJHUXHA-UHFFFAOYSA-N
MW161.20 g/mol
LogP-1.33
Rot. Bonds2

About [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol

[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol (PubChem CID 20677770) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol
PubChem CID20677770
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol
SMILESCN1CC(CO)OC(CO)C1
InChIInChI=1S/C7H15NO3/c1-8-2-6(4-9)11-7(3-8)5-10/h6-7,9-10H,2-5H2,1H3
InChIKeyXKAAYFXKJHUXHA-UHFFFAOYSA-N
XLogP-1.33
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 5-1.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,6R)-2,6-diethyl-4-methylmorpholine
CID 152824903
[(2S,5R)-5-(hydroxymethyl)oxolan-2-yl]methanol
CID 12886254
1-[6-(hydroxymethyl)-4-methylmorpholin-2-yl]-3,5-dimethylpyrimidine-2,4-dione
CID 59283951
[4-(1-methylazetidin-3-yl)morpholin-2-yl]methanol
CID 130138062
1-[(2R,6S)-2,6-bis(hydroxymethyl)morpholin-4-yl]-2,3-dihydroxy-2-methylpropan-1-one
CID 166327594
(4-methylmorpholin-2-yl)methanol;nonane
CID 143690142
N-[2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethyl]acetamide
CID 102935847
[(2S)-4,5-dimethylmorpholin-2-yl]methanol
CID 155290710
[(2S,5R)-4,5-dimethylmorpholin-2-yl]methanol
CID 155290635
[(2R,5S)-4,5-dimethylmorpholin-2-yl]methanol
CID 155291691
[(2S,6S)-4-(5-fluoropentyl)-6-methylmorpholin-2-yl]methanol
CID 124842414
(6-methyl-4-pent-3-ynylmorpholin-2-yl)methanol
CID 102935514

Frequently Asked Questions

What is the IUPAC name of [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol?
The IUPAC name of [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol (CID 20677770) is [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol?
The canonical SMILES for [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol is CN1CC(CO)OC(CO)C1.
What is the InChIKey of [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol?
The InChIKey is XKAAYFXKJHUXHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-8-2-6(4-9)11-7(3-8)5-10/h6-7,9-10H,2-5H2,1H3.
What are the key properties of [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol?
[6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol has a molecular weight of 161.20 g/mol, XLogP of -1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(hydroxymethyl)-4-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 20677770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).