(1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine

C14H22N2O — CID 78934940

IUPAC(1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine
SMILESC[C@@H](N)c1ccc(N2CCOCC2(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-11(15)12-4-6-13(7-5-12)16-8-9-17-10-14(16,2)3/h4-7,11H,8-10,15H2,1-3H3/t11-/m1/s1
InChIKeyFXCJPGHVCIRATC-LLVKDONJSA-N
MW234.34 g/mol
LogP2.32
Rot. Bonds2

About (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine

(1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine (PubChem CID 78934940) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine
PubChem CID78934940
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine
SMILESC[C@@H](N)c1ccc(N2CCOCC2(C)C)cc1
InChIInChI=1S/C14H22N2O/c1-11(15)12-4-6-13(7-5-12)16-8-9-17-10-14(16,2)3/h4-7,11H,8-10,15H2,1-3H3/t11-/m1/s1
InChIKeyFXCJPGHVCIRATC-LLVKDONJSA-N
XLogP2.32
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine?
The IUPAC name of (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine (CID 78934940) is (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine.
What is the SMILES notation for (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine?
The canonical SMILES for (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine is C[C@@H](N)c1ccc(N2CCOCC2(C)C)cc1.
What is the InChIKey of (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine?
The InChIKey is FXCJPGHVCIRATC-LLVKDONJSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(15)12-4-6-13(7-5-12)16-8-9-17-10-14(16,2)3/h4-7,11H,8-10,15H2,1-3H3/t11-/m1/s1.
What are the key properties of (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine?
(1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine has a molecular weight of 234.34 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-(3,3-dimethylmorpholin-4-yl)phenyl]ethanamine is sourced from PubChem (CID 78934940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).