2-(2-ethoxyethyl)aniline

C10H15NO — CID 14619442

IUPAC2-(2-ethoxyethyl)aniline
SMILESCCOCCc1ccccc1N
InChIInChI=1S/C10H15NO/c1-2-12-8-7-9-5-3-4-6-10(9)11/h3-6H,2,7-8,11H2,1H3
InChIKeyXJVOQTIKSQWDTM-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.85
Rot. Bonds4

About 2-(2-ethoxyethyl)aniline

2-(2-ethoxyethyl)aniline (PubChem CID 14619442) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-(2-ethoxyethyl)aniline.

Molecular Properties

Compound Name2-(2-ethoxyethyl)aniline
PubChem CID14619442
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-(2-ethoxyethyl)aniline
SMILESCCOCCc1ccccc1N
InChIInChI=1S/C10H15NO/c1-2-12-8-7-9-5-3-4-6-10(9)11/h3-6H,2,7-8,11H2,1H3
InChIKeyXJVOQTIKSQWDTM-UHFFFAOYSA-N
XLogP1.85
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-fluoroethoxy)ethyl]aniline
CID 102902179
2-[3-[2-ethoxyethyl(ethyl)amino]propyl]aniline
CID 107274493
3-(2-aminophenyl)-N-(2-ethoxyethyl)-N-methylpropanamide
CID 81061981
2-(2-pentan-3-yloxyethyl)aniline
CID 102902683
2-[[2-ethoxyethyl(methyl)amino]methyl]aniline
CID 43458606
2-[2-(2-aminophenyl)ethoxy]-N-cyclopropyl-N-ethylacetamide
CID 102902326
3-(2-aminophenyl)-N-(4-ethoxybutyl)propanamide;hydrochloride
CID 120609020
2-(2-ethoxyethyl)benzonitrile
CID 134604790
2-[2-[(3,5-difluorophenyl)methoxy]ethyl]aniline
CID 102902193
ethane;2-ethylaniline
CID 90841248
2-ethylaniline;propane
CID 143529464
3-(2-ethoxyethoxymethyl)-2-methylaniline
CID 43509333

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethyl)aniline?
The IUPAC name of 2-(2-ethoxyethyl)aniline (CID 14619442) is 2-(2-ethoxyethyl)aniline.
What is the SMILES notation for 2-(2-ethoxyethyl)aniline?
The canonical SMILES for 2-(2-ethoxyethyl)aniline is CCOCCc1ccccc1N.
What is the InChIKey of 2-(2-ethoxyethyl)aniline?
The InChIKey is XJVOQTIKSQWDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-12-8-7-9-5-3-4-6-10(9)11/h3-6H,2,7-8,11H2,1H3.
What are the key properties of 2-(2-ethoxyethyl)aniline?
2-(2-ethoxyethyl)aniline has a molecular weight of 165.24 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethyl)aniline is sourced from PubChem (CID 14619442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).