[3-(4-ethoxyphenoxy)phenyl]methanamine

C15H17NO2 — CID 58104515

IUPAC[3-(4-ethoxyphenoxy)phenyl]methanamine
SMILESCCOc1ccc(Oc2cccc(CN)c2)cc1
InChIInChI=1S/C15H17NO2/c1-2-17-13-6-8-14(9-7-13)18-15-5-3-4-12(10-15)11-16/h3-10H,2,11,16H2,1H3
InChIKeyAIGQCOHGNJENDR-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.34
Rot. Bonds5

About [3-(4-ethoxyphenoxy)phenyl]methanamine

[3-(4-ethoxyphenoxy)phenyl]methanamine (PubChem CID 58104515) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is [3-(4-ethoxyphenoxy)phenyl]methanamine.

Molecular Properties

Compound Name[3-(4-ethoxyphenoxy)phenyl]methanamine
PubChem CID58104515
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name[3-(4-ethoxyphenoxy)phenyl]methanamine
SMILESCCOc1ccc(Oc2cccc(CN)c2)cc1
InChIInChI=1S/C15H17NO2/c1-2-17-13-6-8-14(9-7-13)18-15-5-3-4-12(10-15)11-16/h3-10H,2,11,16H2,1H3
InChIKeyAIGQCOHGNJENDR-UHFFFAOYSA-N
XLogP3.34
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-(4-ethoxyphenoxy)phenyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-(4-ethoxyphenoxy)phenyl]ethanamine
CID 63941757
1-[3-(4-ethoxyphenoxy)phenyl]propan-2-amine
CID 63941952
[3-[(4-ethoxyphenyl)methyl]phenyl]methanamine
CID 116926187
[5-(3-ethoxyphenoxy)-3-pyridinyl]methanamine
CID 113469599
3-(aminomethyl)-N-(4-ethoxyphenyl)-N-methylaniline
CID 117029128
4-ethoxyaniline;phenylmethanamine
CID 172737441
[3-[2-(4-methoxyphenoxy)ethoxy]phenyl]methanamine
CID 20989430
[4-[2-(3-ethylphenoxy)ethoxy]phenyl]methanamine
CID 43254277
[3-(3-propan-2-ylphenoxy)phenyl]methanamine
CID 63943480
[4-[(4-ethoxyphenoxy)methyl]phenyl]methanamine
CID 16787344
[3-(3-fluorophenoxy)phenyl]methanamine hydroxide
CID 86649819
3-(3-ethoxyphenyl)-2-(3-phenoxyphenyl)propan-1-amine
CID 112538857

Frequently Asked Questions

What is the IUPAC name of [3-(4-ethoxyphenoxy)phenyl]methanamine?
The IUPAC name of [3-(4-ethoxyphenoxy)phenyl]methanamine (CID 58104515) is [3-(4-ethoxyphenoxy)phenyl]methanamine.
What is the SMILES notation for [3-(4-ethoxyphenoxy)phenyl]methanamine?
The canonical SMILES for [3-(4-ethoxyphenoxy)phenyl]methanamine is CCOc1ccc(Oc2cccc(CN)c2)cc1.
What is the InChIKey of [3-(4-ethoxyphenoxy)phenyl]methanamine?
The InChIKey is AIGQCOHGNJENDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-2-17-13-6-8-14(9-7-13)18-15-5-3-4-12(10-15)11-16/h3-10H,2,11,16H2,1H3.
What are the key properties of [3-(4-ethoxyphenoxy)phenyl]methanamine?
[3-(4-ethoxyphenoxy)phenyl]methanamine has a molecular weight of 243.31 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-ethoxyphenoxy)phenyl]methanamine is sourced from PubChem (CID 58104515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).