(2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine

C₁₃H₂₆N₂O — CID 165463507

About (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine

(2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine (PubChem CID 165463507) has the molecular formula C₁₃H₂₆N₂O and a molecular weight of 226.36 g/mol. Its IUPAC name is (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine.

Molecular Properties

• Compound Name: (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine
• PubChem CID: 165463507
• Molecular Formula: C₁₃H₂₆N₂O
• Molecular Weight: 226.36 g/mol
• Exact Mass: 226.20
• IUPAC Name: (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine
• SMILES: CC1CNCC(C)C1N1C[C@@H](C)O[C@@H](C)C1
• InChI: InChI=1S/C13H26N2O/c1-9-5-14-6-10(2)13(9)15-7-11(3)16-12(4)8-15/h9-14H,5-8H2,1-4H3/t9?,10?,11-,12+,13?
• InChIKey: JRXAFXCGPCZSIK-ACDMLXGOSA-N
• XLogP: 1.34
• TPSA: 24.50 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 1
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	226.36
LogP ≤ 5	1.34
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine?

The IUPAC name of (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine (CID 165463507) is (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine.

What is the SMILES notation for (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine?

The canonical SMILES for (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine is CC1CNCC(C)C1N1C[C@@H](C)O[C@@H](C)C1.

What is the InChIKey of (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine?

The InChIKey is JRXAFXCGPCZSIK-ACDMLXGOSA-N. The full InChI is InChI=1S/C13H26N2O/c1-9-5-14-6-10(2)13(9)15-7-11(3)16-12(4)8-15/h9-14H,5-8H2,1-4H3/t9?,10?,11-,12+,13?.

What are the key properties of (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine?

(2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine has a molecular weight of 226.36 g/mol, XLogP of 1.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,6S)-4-(3,5-dimethylpiperidin-4-yl)-2,6-dimethylmorpholine is sourced from PubChem (CID 165463507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 165463507 — identifiers, structure, computed properties (public domain)

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