1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine

C14H22N2O — CID 43592908

IUPAC1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine
SMILESCC(N)c1ccccc1N1CCOC(C)(C)C1
InChIInChI=1S/C14H22N2O/c1-11(15)12-6-4-5-7-13(12)16-8-9-17-14(2,3)10-16/h4-7,11H,8-10,15H2,1-3H3
InChIKeyVNHCLYZEDDXVSK-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.32
Rot. Bonds2

About 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine

1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine (PubChem CID 43592908) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine
PubChem CID43592908
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine
SMILESCC(N)c1ccccc1N1CCOC(C)(C)C1
InChIInChI=1S/C14H22N2O/c1-11(15)12-6-4-5-7-13(12)16-8-9-17-14(2,3)10-16/h4-7,11H,8-10,15H2,1-3H3
InChIKeyVNHCLYZEDDXVSK-UHFFFAOYSA-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 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine?
The IUPAC name of 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine (CID 43592908) is 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine.
What is the SMILES notation for 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine?
The canonical SMILES for 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine is CC(N)c1ccccc1N1CCOC(C)(C)C1.
What is the InChIKey of 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine?
The InChIKey is VNHCLYZEDDXVSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11(15)12-6-4-5-7-13(12)16-8-9-17-14(2,3)10-16/h4-7,11H,8-10,15H2,1-3H3.
What are the key properties of 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine?
1-[2-(2,2-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 1-[2-(2,2-dimethylmorpholin-4-yl)phenyl]ethanamine is sourced from PubChem (CID 43592908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).