[(2S,3S)-2-methylmorpholin-3-yl]methanol

C6H13NO2 — CID 53338734

IUPAC[(2S,3S)-2-methylmorpholin-3-yl]methanol
SMILESC[C@@H]1OCCN[C@H]1CO
InChIInChI=1S/C6H13NO2/c1-5-6(4-8)7-2-3-9-5/h5-8H,2-4H2,1H3/t5-,6-/m0/s1
InChIKeyPWDXWDJQJUXDSL-WDSKDSINSA-N
MW131.18 g/mol
LogP-0.64
Rot. Bonds1

About [(2S,3S)-2-methylmorpholin-3-yl]methanol

[(2S,3S)-2-methylmorpholin-3-yl]methanol (PubChem CID 53338734) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is [(2S,3S)-2-methylmorpholin-3-yl]methanol.

Molecular Properties

Compound Name[(2S,3S)-2-methylmorpholin-3-yl]methanol
PubChem CID53338734
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC Name[(2S,3S)-2-methylmorpholin-3-yl]methanol
SMILESC[C@@H]1OCCN[C@H]1CO
InChIInChI=1S/C6H13NO2/c1-5-6(4-8)7-2-3-9-5/h5-8H,2-4H2,1H3/t5-,6-/m0/s1
InChIKeyPWDXWDJQJUXDSL-WDSKDSINSA-N
XLogP-0.64
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S,3S)-2-methylmorpholin-3-yl]methanol?
The IUPAC name of [(2S,3S)-2-methylmorpholin-3-yl]methanol (CID 53338734) is [(2S,3S)-2-methylmorpholin-3-yl]methanol.
What is the SMILES notation for [(2S,3S)-2-methylmorpholin-3-yl]methanol?
The canonical SMILES for [(2S,3S)-2-methylmorpholin-3-yl]methanol is C[C@@H]1OCCN[C@H]1CO.
What is the InChIKey of [(2S,3S)-2-methylmorpholin-3-yl]methanol?
The InChIKey is PWDXWDJQJUXDSL-WDSKDSINSA-N. The full InChI is InChI=1S/C6H13NO2/c1-5-6(4-8)7-2-3-9-5/h5-8H,2-4H2,1H3/t5-,6-/m0/s1.
What are the key properties of [(2S,3S)-2-methylmorpholin-3-yl]methanol?
[(2S,3S)-2-methylmorpholin-3-yl]methanol has a molecular weight of 131.18 g/mol, XLogP of -0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3S)-2-methylmorpholin-3-yl]methanol is sourced from PubChem (CID 53338734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).