N-ethyl-1-(4-phenoxyphenyl)ethanamine

C16H19NO — CID 43285534

IUPACN-ethyl-1-(4-phenoxyphenyl)ethanamine
SMILESCCNC(C)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C16H19NO/c1-3-17-13(2)14-9-11-16(12-10-14)18-15-7-5-4-6-8-15/h4-13,17H,3H2,1-2H3
InChIKeyXJGOEGPETQZTEJ-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.15
Rot. Bonds5

About N-ethyl-1-(4-phenoxyphenyl)ethanamine

N-ethyl-1-(4-phenoxyphenyl)ethanamine (PubChem CID 43285534) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-ethyl-1-(4-phenoxyphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-phenoxyphenyl)ethanamine
PubChem CID43285534
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-ethyl-1-(4-phenoxyphenyl)ethanamine
SMILESCCNC(C)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C16H19NO/c1-3-17-13(2)14-9-11-16(12-10-14)18-15-7-5-4-6-8-15/h4-13,17H,3H2,1-2H3
InChIKeyXJGOEGPETQZTEJ-UHFFFAOYSA-N
XLogP4.15
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(3-chlorophenoxy)phenyl]-N-ethylethanamine
CID 43285575
N-ethyl-2-methyl-1-(4-phenoxyphenyl)butan-1-amine
CID 43489608
N-ethyl-1-[4-(2-iodophenoxy)phenyl]ethanamine
CID 43479753
N-ethyl-1-(4-phenoxyphenyl)propan-1-amine
CID 43489604
(1S)-N-methyl-1-(4-phenoxyphenyl)ethanamine
CID 67664030
ethane;N-ethyl-1-(4-methoxyphenyl)ethanamine
CID 143132018
(1R)-1-[4-[(2R)-butan-2-yl]oxyphenyl]-N-ethylethanamine
CID 93007249
N-[cyclopropyl-(4-phenoxyphenyl)methyl]ethanamine
CID 43489609
N-ethyl-1-[4-(trifluoromethoxy)phenyl]ethanamine
CID 24697408
N-ethyl-1-[4-(4-methylpentan-2-yloxy)phenyl]ethanamine
CID 43285161
1-[4-(2,5-dimethylphenoxy)phenyl]-N-ethylethanamine
CID 43285455
1-[4-(2,2-difluoroethoxy)phenyl]-N-ethylethanamine
CID 60921749

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-phenoxyphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-phenoxyphenyl)ethanamine (CID 43285534) is N-ethyl-1-(4-phenoxyphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-phenoxyphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-phenoxyphenyl)ethanamine is CCNC(C)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-ethyl-1-(4-phenoxyphenyl)ethanamine?
The InChIKey is XJGOEGPETQZTEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-17-13(2)14-9-11-16(12-10-14)18-15-7-5-4-6-8-15/h4-13,17H,3H2,1-2H3.
What are the key properties of N-ethyl-1-(4-phenoxyphenyl)ethanamine?
N-ethyl-1-(4-phenoxyphenyl)ethanamine has a molecular weight of 241.33 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-phenoxyphenyl)ethanamine is sourced from PubChem (CID 43285534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).