2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine

C11H21N3O — CID 70892530

IUPAC2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine
SMILESC[C@@H]1CN(C2CC=C(N)CN2)C[C@H](C)O1
InChIInChI=1S/C11H21N3O/c1-8-6-14(7-9(2)15-8)11-4-3-10(12)5-13-11/h3,8-9,11,13H,4-7,12H2,1-2H3/t8-,9+,11?
InChIKeyNYYUDZSFICDBJV-SLHIUPAKSA-N
MW211.31 g/mol
LogP0.26
Rot. Bonds1

About 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine

2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine (PubChem CID 70892530) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine.

Molecular Properties

Compound Name2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine
PubChem CID70892530
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine
SMILESC[C@@H]1CN(C2CC=C(N)CN2)C[C@H](C)O1
InChIInChI=1S/C11H21N3O/c1-8-6-14(7-9(2)15-8)11-4-3-10(12)5-13-11/h3,8-9,11,13H,4-7,12H2,1-2H3/t8-,9+,11?
InChIKeyNYYUDZSFICDBJV-SLHIUPAKSA-N
XLogP0.26
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine?
The IUPAC name of 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine (CID 70892530) is 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine.
What is the SMILES notation for 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine?
The canonical SMILES for 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine is C[C@@H]1CN(C2CC=C(N)CN2)C[C@H](C)O1.
What is the InChIKey of 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine?
The InChIKey is NYYUDZSFICDBJV-SLHIUPAKSA-N. The full InChI is InChI=1S/C11H21N3O/c1-8-6-14(7-9(2)15-8)11-4-3-10(12)5-13-11/h3,8-9,11,13H,4-7,12H2,1-2H3/t8-,9+,11?.
What are the key properties of 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine?
2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine has a molecular weight of 211.31 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,2,3,6-tetrahydropyridin-5-amine is sourced from PubChem (CID 70892530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).