N,N-dimethyl-2-(2-phenylphenoxy)ethanamine

C16H19NO — CID 888197

IUPACN,N-dimethyl-2-(2-phenylphenoxy)ethanamine
SMILESCN(C)CCOc1ccccc1-c1ccccc1
InChIInChI=1S/C16H19NO/c1-17(2)12-13-18-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKeyHEGXUUYKFGNKJB-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.29
Rot. Bonds5

About N,N-dimethyl-2-(2-phenylphenoxy)ethanamine

N,N-dimethyl-2-(2-phenylphenoxy)ethanamine (PubChem CID 888197) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-phenylphenoxy)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-phenylphenoxy)ethanamine
PubChem CID888197
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN,N-dimethyl-2-(2-phenylphenoxy)ethanamine
SMILESCN(C)CCOc1ccccc1-c1ccccc1
InChIInChI=1S/C16H19NO/c1-17(2)12-13-18-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKeyHEGXUUYKFGNKJB-UHFFFAOYSA-N
XLogP3.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-phenylphenoxy)ethanamine?
The IUPAC name of N,N-dimethyl-2-(2-phenylphenoxy)ethanamine (CID 888197) is N,N-dimethyl-2-(2-phenylphenoxy)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(2-phenylphenoxy)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(2-phenylphenoxy)ethanamine is CN(C)CCOc1ccccc1-c1ccccc1.
What is the InChIKey of N,N-dimethyl-2-(2-phenylphenoxy)ethanamine?
The InChIKey is HEGXUUYKFGNKJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-17(2)12-13-18-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(2-phenylphenoxy)ethanamine?
N,N-dimethyl-2-(2-phenylphenoxy)ethanamine has a molecular weight of 241.33 g/mol, XLogP of 3.29, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-phenylphenoxy)ethanamine is sourced from PubChem (CID 888197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).