[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol

C9H19NO2 — CID 169228697

IUPAC[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol
SMILESCC(C)(C)[C@@H]1CNC[C@@H](CO)O1
InChIInChI=1S/C9H19NO2/c1-9(2,3)8-5-10-4-7(6-11)12-8/h7-8,10-11H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKeyCWTIRLHEZRAANZ-YUMQZZPRSA-N
MW173.26 g/mol
LogP0.38
Rot. Bonds1

About [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol

[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol (PubChem CID 169228697) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol
PubChem CID169228697
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol
SMILESCC(C)(C)[C@@H]1CNC[C@@H](CO)O1
InChIInChI=1S/C9H19NO2/c1-9(2,3)8-5-10-4-7(6-11)12-8/h7-8,10-11H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKeyCWTIRLHEZRAANZ-YUMQZZPRSA-N
XLogP0.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol?
The IUPAC name of [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol (CID 169228697) is [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol.
What is the SMILES notation for [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol?
The canonical SMILES for [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol is CC(C)(C)[C@@H]1CNC[C@@H](CO)O1.
What is the InChIKey of [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol?
The InChIKey is CWTIRLHEZRAANZ-YUMQZZPRSA-N. The full InChI is InChI=1S/C9H19NO2/c1-9(2,3)8-5-10-4-7(6-11)12-8/h7-8,10-11H,4-6H2,1-3H3/t7-,8-/m0/s1.
What are the key properties of [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol?
[(2S,6R)-6-tert-butylmorpholin-2-yl]methanol has a molecular weight of 173.26 g/mol, XLogP of 0.38, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6R)-6-tert-butylmorpholin-2-yl]methanol is sourced from PubChem (CID 169228697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).