1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine

C15H24N2O — CID 43592951

IUPAC1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine
SMILESCC1(C)CN(CC(N)Cc2ccccc2)CCO1
InChIInChI=1S/C15H24N2O/c1-15(2)12-17(8-9-18-15)11-14(16)10-13-6-4-3-5-7-13/h3-7,14H,8-12,16H2,1-2H3
InChIKeyPDDIEBONRWUOHG-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.67
Rot. Bonds4

About 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine

1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine (PubChem CID 43592951) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine.

Molecular Properties

Compound Name1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine
PubChem CID43592951
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine
SMILESCC1(C)CN(CC(N)Cc2ccccc2)CCO1
InChIInChI=1S/C15H24N2O/c1-15(2)12-17(8-9-18-15)11-14(16)10-13-6-4-3-5-7-13/h3-7,14H,8-12,16H2,1-2H3
InChIKeyPDDIEBONRWUOHG-UHFFFAOYSA-N
XLogP1.67
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)propan-2-amine
CID 102744386
(2S)-2-amino-1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-1-one;hydrochloride
CID 119294272
1-(2,2-dimethylmorpholin-4-yl)-3-phenylmethoxypropan-2-ol
CID 60761061
1-(2-aminophenyl)-2-(2,2-dimethylmorpholin-4-yl)ethanol
CID 62265085
1-(4,4-diethylpiperidin-1-yl)-3-phenylpropan-2-amine
CID 63161280
2-(2,2-dimethylmorpholin-4-yl)-1-[4-(2-methylpropyl)phenyl]ethanol
CID 60981558
1-(2,2-dimethylmorpholin-4-yl)-3,3-dimethylbutan-2-amine
CID 43592748
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-phenylpropan-2-amine
CID 104959145
1-(8-azaspiro[4.5]decan-8-yl)-3-phenylpropan-2-amine
CID 63161076
(2S)-2-amino-1-(2,2-dimethylmorpholin-4-yl)-4-phenylbutan-1-one
CID 104983964
1-(2-bromophenyl)-3-(2,2-dimethylmorpholin-4-yl)propan-1-amine
CID 55098553
2-amino-N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-phenylacetamide;dihydrochloride
CID 119868874

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine?
The IUPAC name of 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine (CID 43592951) is 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine.
What is the SMILES notation for 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine?
The canonical SMILES for 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine is CC1(C)CN(CC(N)Cc2ccccc2)CCO1.
What is the InChIKey of 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine?
The InChIKey is PDDIEBONRWUOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-15(2)12-17(8-9-18-15)11-14(16)10-13-6-4-3-5-7-13/h3-7,14H,8-12,16H2,1-2H3.
What are the key properties of 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine?
1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine has a molecular weight of 248.37 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylmorpholin-4-yl)-3-phenylpropan-2-amine is sourced from PubChem (CID 43592951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).