(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine

C10H21NO3 — CID 104959389

IUPAC(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine
SMILESCOC(CN1C[C@@H](C)O[C@@H](C)C1)OC
InChIInChI=1S/C10H21NO3/c1-8-5-11(6-9(2)14-8)7-10(12-3)13-4/h8-10H,5-7H2,1-4H3/t8-,9+
InChIKeyNQURUCJBNHYBIW-DTORHVGOSA-N
MW203.28 g/mol
LogP0.71
Rot. Bonds4

About (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine

(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine (PubChem CID 104959389) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine
PubChem CID104959389
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine
SMILESCOC(CN1C[C@@H](C)O[C@@H](C)C1)OC
InChIInChI=1S/C10H21NO3/c1-8-5-11(6-9(2)14-8)7-10(12-3)13-4/h8-10H,5-7H2,1-4H3/t8-,9+
InChIKeyNQURUCJBNHYBIW-DTORHVGOSA-N
XLogP0.71
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine?
The IUPAC name of (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine (CID 104959389) is (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine.
What is the SMILES notation for (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine?
The canonical SMILES for (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine is COC(CN1C[C@@H](C)O[C@@H](C)C1)OC.
What is the InChIKey of (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine?
The InChIKey is NQURUCJBNHYBIW-DTORHVGOSA-N. The full InChI is InChI=1S/C10H21NO3/c1-8-5-11(6-9(2)14-8)7-10(12-3)13-4/h8-10H,5-7H2,1-4H3/t8-,9+.
What are the key properties of (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine?
(2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine has a molecular weight of 203.28 g/mol, XLogP of 0.71, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6S)-4-(2,2-dimethoxyethyl)-2,6-dimethylmorpholine is sourced from PubChem (CID 104959389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).