2-(4-ethoxyphenoxy)-4-methylaniline

C15H17NO2 — CID 26189599

IUPAC2-(4-ethoxyphenoxy)-4-methylaniline
SMILESCCOc1ccc(Oc2cc(C)ccc2N)cc1
InChIInChI=1S/C15H17NO2/c1-3-17-12-5-7-13(8-6-12)18-15-10-11(2)4-9-14(15)16/h4-10H,3,16H2,1-2H3
InChIKeyIWCSOWVIYBANPV-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.77
Rot. Bonds4

About 2-(4-ethoxyphenoxy)-4-methylaniline

2-(4-ethoxyphenoxy)-4-methylaniline (PubChem CID 26189599) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(4-ethoxyphenoxy)-4-methylaniline.

Molecular Properties

Compound Name2-(4-ethoxyphenoxy)-4-methylaniline
PubChem CID26189599
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-(4-ethoxyphenoxy)-4-methylaniline
SMILESCCOc1ccc(Oc2cc(C)ccc2N)cc1
InChIInChI=1S/C15H17NO2/c1-3-17-12-5-7-13(8-6-12)18-15-10-11(2)4-9-14(15)16/h4-10H,3,16H2,1-2H3
InChIKeyIWCSOWVIYBANPV-UHFFFAOYSA-N
XLogP3.77
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-ethoxyphenoxy)-4-methylaniline
CID 26189621
2-(4-fluorophenoxy)-4-methylaniline
CID 26189590
2-(2-ethoxyphenoxy)-4-methylaniline
CID 26189556
2-(ethoxymethoxy)-4-methylaniline
CID 65365090
2-(4-methylphenoxy)benzene-1,4-diamine
CID 163806910
2-(4-ethoxyphenoxy)-4-methylbenzenecarboximidamide
CID 62307304
5-methyl-2-(4-propoxyphenoxy)aniline
CID 43168923
4-(4-ethoxyphenoxy)-2-propoxyaniline
CID 63676127
4-methyl-2-(3-methylphenoxy)aniline
CID 26189584
3-(2,5-dimethylphenoxy)-5-ethoxyaniline
CID 80748606
4-bromo-2-(4-methylphenoxy)aniline
CID 65342479
4-(3,5-dimethylphenoxy)-2-ethoxyaniline
CID 63676933

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenoxy)-4-methylaniline?
The IUPAC name of 2-(4-ethoxyphenoxy)-4-methylaniline (CID 26189599) is 2-(4-ethoxyphenoxy)-4-methylaniline.
What is the SMILES notation for 2-(4-ethoxyphenoxy)-4-methylaniline?
The canonical SMILES for 2-(4-ethoxyphenoxy)-4-methylaniline is CCOc1ccc(Oc2cc(C)ccc2N)cc1.
What is the InChIKey of 2-(4-ethoxyphenoxy)-4-methylaniline?
The InChIKey is IWCSOWVIYBANPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-3-17-12-5-7-13(8-6-12)18-15-10-11(2)4-9-14(15)16/h4-10H,3,16H2,1-2H3.
What are the key properties of 2-(4-ethoxyphenoxy)-4-methylaniline?
2-(4-ethoxyphenoxy)-4-methylaniline has a molecular weight of 243.31 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenoxy)-4-methylaniline is sourced from PubChem (CID 26189599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).