(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine

C11H22N2O2 — CID 58469905

IUPAC(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine
SMILESCC(C)(C)O[C@H]1CN(C2CNC2)CCO1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)15-10-8-13(4-5-14-10)9-6-12-7-9/h9-10,12H,4-8H2,1-3H3/t10-/m0/s1
InChIKeyWWFUFQPGHYDTND-JTQLQIEISA-N
MW214.31 g/mol
LogP0.43
Rot. Bonds2

About (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine

(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine (PubChem CID 58469905) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine.

Molecular Properties

Compound Name(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine
PubChem CID58469905
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine
SMILESCC(C)(C)O[C@H]1CN(C2CNC2)CCO1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)15-10-8-13(4-5-14-10)9-6-12-7-9/h9-10,12H,4-8H2,1-3H3/t10-/m0/s1
InChIKeyWWFUFQPGHYDTND-JTQLQIEISA-N
XLogP0.43
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine?
The IUPAC name of (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine (CID 58469905) is (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine.
What is the SMILES notation for (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine?
The canonical SMILES for (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine is CC(C)(C)O[C@H]1CN(C2CNC2)CCO1.
What is the InChIKey of (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine?
The InChIKey is WWFUFQPGHYDTND-JTQLQIEISA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,3)15-10-8-13(4-5-14-10)9-6-12-7-9/h9-10,12H,4-8H2,1-3H3/t10-/m0/s1.
What are the key properties of (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine?
(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine has a molecular weight of 214.31 g/mol, XLogP of 0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine is sourced from PubChem (CID 58469905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).