(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine

C14H22N2O — CID 30072743

IUPAC(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine
SMILESC[C@@H]1CN(C[C@H](N)c2ccccc2)C[C@H](C)O1
InChIInChI=1S/C14H22N2O/c1-11-8-16(9-12(2)17-11)10-14(15)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,15H2,1-2H3/t11-,12+,14-/m0/s1
InChIKeyKOEBWBGFCKJDGH-SCRDCRAPSA-N
MW234.34 g/mol
LogP1.80
Rot. Bonds3

About (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine

(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine (PubChem CID 30072743) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine.

Molecular Properties

Compound Name(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine
PubChem CID30072743
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine
SMILESC[C@@H]1CN(C[C@H](N)c2ccccc2)C[C@H](C)O1
InChIInChI=1S/C14H22N2O/c1-11-8-16(9-12(2)17-11)10-14(15)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,15H2,1-2H3/t11-,12+,14-/m0/s1
InChIKeyKOEBWBGFCKJDGH-SCRDCRAPSA-N
XLogP1.80
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-dimethylmorpholin-4-yl)-1-(3-methylphenyl)ethanamine
CID 61310482
1-(4-tert-butylphenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanamine
CID 16786128
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanol
CID 103936768
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-phenylpropan-2-amine
CID 104959145
N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethyl]propan-1-amine
CID 104958381
3-(2,6-dimethylmorpholin-4-yl)-N'-hydroxy-2-phenylpropanimidamide
CID 77043553
2-(3-fluoroazetidin-1-yl)-1-phenylethanamine;hydrochloride
CID 134586238
1-[(2S)-2-amino-2-phenylethyl]-N,N,4-trimethylpyrrolidin-3-amine
CID 112736995
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-(3-fluoro-4-methoxyphenyl)ethanamine
CID 107522093
[4-(3-amino-2-methyl-3-phenylpropyl)-6-methylmorpholin-2-yl]methanol
CID 102936336
2-(2,5-dimethylmorpholin-4-yl)-1-phenylethanamine
CID 43544546
(2R,6R)-N-[(2S)-2-amino-2-phenylethyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 124670346

Frequently Asked Questions

What is the IUPAC name of (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine?
The IUPAC name of (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine (CID 30072743) is (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine.
What is the SMILES notation for (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine?
The canonical SMILES for (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine is C[C@@H]1CN(C[C@H](N)c2ccccc2)C[C@H](C)O1.
What is the InChIKey of (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine?
The InChIKey is KOEBWBGFCKJDGH-SCRDCRAPSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-8-16(9-12(2)17-11)10-14(15)13-6-4-3-5-7-13/h3-7,11-12,14H,8-10,15H2,1-2H3/t11-,12+,14-/m0/s1.
What are the key properties of (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine?
(1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine has a molecular weight of 234.34 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-1-phenylethanamine is sourced from PubChem (CID 30072743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).