2-(2-ethoxyphenoxy)-4-methylaniline

C15H17NO2 — CID 26189556

IUPAC2-(2-ethoxyphenoxy)-4-methylaniline
SMILESCCOc1ccccc1Oc1cc(C)ccc1N
InChIInChI=1S/C15H17NO2/c1-3-17-13-6-4-5-7-14(13)18-15-10-11(2)8-9-12(15)16/h4-10H,3,16H2,1-2H3
InChIKeyMMKQAMYPXVGKQK-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.77
Rot. Bonds4

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

2-(2-ethoxyphenoxy)-4-methylaniline (PubChem CID 26189556) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(2-ethoxyphenoxy)-4-methylaniline.

Molecular Properties

Compound Name2-(2-ethoxyphenoxy)-4-methylaniline
PubChem CID26189556
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-(2-ethoxyphenoxy)-4-methylaniline
SMILESCCOc1ccccc1Oc1cc(C)ccc1N
InChIInChI=1S/C15H17NO2/c1-3-17-13-6-4-5-7-14(13)18-15-10-11(2)8-9-12(15)16/h4-10H,3,16H2,1-2H3
InChIKeyMMKQAMYPXVGKQK-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-(4-ethoxyphenoxy)-4-methylaniline
CID 26189599
2-(3-ethoxyphenoxy)-4-methylaniline
CID 26189621
2-(2-ethoxyphenoxy)-5-methylbenzenecarbothioamide
CID 107929491
2-(2-ethoxyphenyl)-5-methylaniline
CID 82766449
2-(2-amino-5-methylphenoxy)benzonitrile
CID 43363961
4-ethoxy-5-fluoro-2-(2-fluoro-5-methylphenoxy)aniline
CID 64853412
4-methyl-2-[2-(2-methylphenoxy)ethoxy]aniline
CID 39359276
2-(fluoromethoxy)-4-methylaniline
CID 123529275
2-(ethoxymethoxy)-4-methylaniline
CID 65365090
2-ethoxyaniline;molecular hydrogen
CID 144877970
O-(2-ethoxyphenyl)hydroxylamine
CID 70279336
4-methyl-2-propoxyaniline
CID 24698653

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenoxy)-4-methylaniline?
The IUPAC name of 2-(2-ethoxyphenoxy)-4-methylaniline (CID 26189556) is 2-(2-ethoxyphenoxy)-4-methylaniline.
What is the SMILES notation for 2-(2-ethoxyphenoxy)-4-methylaniline?
The canonical SMILES for 2-(2-ethoxyphenoxy)-4-methylaniline is CCOc1ccccc1Oc1cc(C)ccc1N.
What is the InChIKey of 2-(2-ethoxyphenoxy)-4-methylaniline?
The InChIKey is MMKQAMYPXVGKQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-3-17-13-6-4-5-7-14(13)18-15-10-11(2)8-9-12(15)16/h4-10H,3,16H2,1-2H3.
What are the key properties of 2-(2-ethoxyphenoxy)-4-methylaniline?
2-(2-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-(2-ethoxyphenoxy)-4-methylaniline is sourced from PubChem (CID 26189556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).