4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol

C17H21NO2 — CID 43750386

IUPAC4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol
SMILESCCOCc1ccccc1NC(C)c1ccc(O)cc1
InChIInChI=1S/C17H21NO2/c1-3-20-12-15-6-4-5-7-17(15)18-13(2)14-8-10-16(19)11-9-14/h4-11,13,18-19H,3,12H2,1-2H3
InChIKeyLGKGLPZYUXPEAU-UHFFFAOYSA-N
MW271.36 g/mol
LogP4.10
Rot. Bonds6

About 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol

4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol (PubChem CID 43750386) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol.

Molecular Properties

Compound Name4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol
PubChem CID43750386
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol
SMILESCCOCc1ccccc1NC(C)c1ccc(O)cc1
InChIInChI=1S/C17H21NO2/c1-3-20-12-15-6-4-5-7-17(15)18-13(2)14-8-10-16(19)11-9-14/h4-11,13,18-19H,3,12H2,1-2H3
InChIKeyLGKGLPZYUXPEAU-UHFFFAOYSA-N
XLogP4.10
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[2-(ethoxymethyl)anilino]ethyl]benzene-1,4-diol
CID 43750383
4-[1-[2-(2-methoxyethyl)anilino]ethyl]phenol
CID 102903882
2-(ethoxymethyl)-N-[1-(3-fluorophenyl)ethyl]aniline
CID 43750446
N-[1-(3-bromo-4-fluorophenyl)ethyl]-2-(ethoxymethyl)aniline
CID 43792105
2-(ethoxymethyl)-N-(4-methylpentan-2-yl)aniline
CID 43750390
N-[1-(4-ethylphenyl)ethyl]-2-(methoxymethyl)aniline
CID 43677953
4-[1-(2-methylsulfanylanilino)ethyl]phenol
CID 43683440
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-(ethoxymethyl)aniline
CID 43750243
2-(ethoxymethyl)-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
CID 64993290
2-(ethoxymethyl)-N-ethylaniline
CID 43750443
N-[2-(ethoxymethyl)phenyl]-2-methoxypropanamide
CID 112686280
2-(ethoxymethyl)-N-(2-methyl-1-thiophen-2-ylpropyl)aniline
CID 43792087

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol?
The IUPAC name of 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol (CID 43750386) is 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol.
What is the SMILES notation for 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol?
The canonical SMILES for 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol is CCOCc1ccccc1NC(C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol?
The InChIKey is LGKGLPZYUXPEAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-3-20-12-15-6-4-5-7-17(15)18-13(2)14-8-10-16(19)11-9-14/h4-11,13,18-19H,3,12H2,1-2H3.
What are the key properties of 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol?
4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol has a molecular weight of 271.36 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(ethoxymethyl)anilino]ethyl]phenol is sourced from PubChem (CID 43750386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).