2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine

C11H24N2O — CID 104960968

IUPAC2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine
SMILESCCNCC(C)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C11H24N2O/c1-5-12-6-9(2)13-7-10(3)14-11(4)8-13/h9-12H,5-8H2,1-4H3/t9?,10-,11+
InChIKeyWTGSXONMJOLIQF-FGWVZKOKSA-N
MW200.33 g/mol
LogP1.09
Rot. Bonds4

About 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine

2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine (PubChem CID 104960968) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine.

Molecular Properties

Compound Name2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine
PubChem CID104960968
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine
SMILESCCNCC(C)N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C11H24N2O/c1-5-12-6-9(2)13-7-10(3)14-11(4)8-13/h9-12H,5-8H2,1-4H3/t9?,10-,11+
InChIKeyWTGSXONMJOLIQF-FGWVZKOKSA-N
XLogP1.09
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine?
The IUPAC name of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine (CID 104960968) is 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine.
What is the SMILES notation for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine?
The canonical SMILES for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine is CCNCC(C)N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine?
The InChIKey is WTGSXONMJOLIQF-FGWVZKOKSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-12-6-9(2)13-7-10(3)14-11(4)8-13/h9-12H,5-8H2,1-4H3/t9?,10-,11+.
What are the key properties of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine?
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine has a molecular weight of 200.33 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethylpropan-1-amine is sourced from PubChem (CID 104960968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).