N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine

C14H22N2O2 — CID 82538142

IUPACN,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine
SMILESCN(C)CCOc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C14H22N2O2/c1-15(2)7-12-18-14-5-3-13(4-6-14)16-8-10-17-11-9-16/h3-6H,7-12H2,1-2H3
InChIKeyBKXWHEKUXISOSZ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.46
Rot. Bonds5

About N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine

N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine (PubChem CID 82538142) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine
PubChem CID82538142
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine
SMILESCN(C)CCOc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C14H22N2O2/c1-15(2)7-12-18-14-5-3-13(4-6-14)16-8-10-17-11-9-16/h3-6H,7-12H2,1-2H3
InChIKeyBKXWHEKUXISOSZ-UHFFFAOYSA-N
XLogP1.46
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine?
The IUPAC name of N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine (CID 82538142) is N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine is CN(C)CCOc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine?
The InChIKey is BKXWHEKUXISOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-15(2)7-12-18-14-5-3-13(4-6-14)16-8-10-17-11-9-16/h3-6H,7-12H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine?
N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine has a molecular weight of 250.34 g/mol, XLogP of 1.46, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-morpholin-4-ylphenoxy)ethanamine is sourced from PubChem (CID 82538142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).