(2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine

C11H22N2O — CID 795717

IUPAC(2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine
SMILESC[C@@H]1CN(C2CCNCC2)C[C@H](C)O1
InChIInChI=1S/C11H22N2O/c1-9-7-13(8-10(2)14-9)11-3-5-12-6-4-11/h9-12H,3-8H2,1-2H3/t9-,10+
InChIKeyMYYJFAYHVMWIDI-AOOOYVTPSA-N
MW198.31 g/mol
LogP0.85
Rot. Bonds1

About (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine

(2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine (PubChem CID 795717) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine.

Molecular Properties

Compound Name(2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine
PubChem CID795717
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine
SMILESC[C@@H]1CN(C2CCNCC2)C[C@H](C)O1
InChIInChI=1S/C11H22N2O/c1-9-7-13(8-10(2)14-9)11-3-5-12-6-4-11/h9-12H,3-8H2,1-2H3/t9-,10+
InChIKeyMYYJFAYHVMWIDI-AOOOYVTPSA-N
XLogP0.85
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine?
The IUPAC name of (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine (CID 795717) is (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine.
What is the SMILES notation for (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine?
The canonical SMILES for (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine is C[C@@H]1CN(C2CCNCC2)C[C@H](C)O1.
What is the InChIKey of (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine?
The InChIKey is MYYJFAYHVMWIDI-AOOOYVTPSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9-7-13(8-10(2)14-9)11-3-5-12-6-4-11/h9-12H,3-8H2,1-2H3/t9-,10+.
What are the key properties of (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine?
(2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine has a molecular weight of 198.31 g/mol, XLogP of 0.85, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6R)-2,6-dimethyl-4-piperidin-4-ylmorpholine is sourced from PubChem (CID 795717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).