(2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine

C10H14N2O — CID 175885306

IUPAC(2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine
SMILES[2H]C1([2H])CO[C@@H](c2cccc(C)n2)CN1
InChIInChI=1S/C10H14N2O/c1-8-3-2-4-9(12-8)10-7-11-5-6-13-10/h2-4,10-11H,5-7H2,1H3/t10-/m1/s1/i5D2
InChIKeyGACANOMBWRJYBK-VPQSDVOVSA-N
MW180.25 g/mol
LogP1.05
Rot. Bonds1

About (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine

(2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine (PubChem CID 175885306) has the molecular formula C10H14N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine.

Molecular Properties

Compound Name(2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine
PubChem CID175885306
Molecular FormulaC10H14N2O
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name(2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine
SMILES[2H]C1([2H])CO[C@@H](c2cccc(C)n2)CN1
InChIInChI=1S/C10H14N2O/c1-8-3-2-4-9(12-8)10-7-11-5-6-13-10/h2-4,10-11H,5-7H2,1H3/t10-/m1/s1/i5D2
InChIKeyGACANOMBWRJYBK-VPQSDVOVSA-N
XLogP1.05
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine?
The IUPAC name of (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine (CID 175885306) is (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine.
What is the SMILES notation for (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine?
The canonical SMILES for (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine is [2H]C1([2H])CO[C@@H](c2cccc(C)n2)CN1.
What is the InChIKey of (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine?
The InChIKey is GACANOMBWRJYBK-VPQSDVOVSA-N. The full InChI is InChI=1S/C10H14N2O/c1-8-3-2-4-9(12-8)10-7-11-5-6-13-10/h2-4,10-11H,5-7H2,1H3/t10-/m1/s1/i5D2.
What are the key properties of (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine?
(2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine has a molecular weight of 180.25 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5,5-dideuterio-2-(6-methyl-2-pyridinyl)morpholine is sourced from PubChem (CID 175885306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).