3-[(6-ethoxy-2-pyridinyl)oxy]aniline

C13H14N2O2 — CID 63591311

IUPAC3-[(6-ethoxy-2-pyridinyl)oxy]aniline
SMILESCCOc1cccc(Oc2cccc(N)c2)n1
InChIInChI=1S/C13H14N2O2/c1-2-16-12-7-4-8-13(15-12)17-11-6-3-5-10(14)9-11/h3-9H,2,14H2,1H3
InChIKeyVTAUXZPVQLCLQD-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.85
Rot. Bonds4

About 3-[(6-ethoxy-2-pyridinyl)oxy]aniline

3-[(6-ethoxy-2-pyridinyl)oxy]aniline (PubChem CID 63591311) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 3-[(6-ethoxy-2-pyridinyl)oxy]aniline.

Molecular Properties

Compound Name3-[(6-ethoxy-2-pyridinyl)oxy]aniline
PubChem CID63591311
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name3-[(6-ethoxy-2-pyridinyl)oxy]aniline
SMILESCCOc1cccc(Oc2cccc(N)c2)n1
InChIInChI=1S/C13H14N2O2/c1-2-16-12-7-4-8-13(15-12)17-11-6-3-5-10(14)9-11/h3-9H,2,14H2,1H3
InChIKeyVTAUXZPVQLCLQD-UHFFFAOYSA-N
XLogP2.85
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[(6-ethoxy-2-pyridinyl)oxy]-2-fluoroaniline
CID 63590604
3-chloro-4-[(6-ethoxy-2-pyridinyl)oxy]aniline
CID 63589176
3-(6-methoxypyrimidin-4-yl)oxyaniline
CID 66319653
2-bromo-6-(3-ethoxyphenoxy)pyridine
CID 817495
[6-(3-ethoxyphenoxy)-2-pyridinyl]methanol
CID 55060755
ethyl 4-[(6-ethoxy-2-pyridinyl)oxy]benzoate
CID 65019360
2-[(6-ethoxy-2-pyridinyl)oxy]-4-fluoroaniline
CID 63591670
2-[(6-ethoxy-2-pyridinyl)oxy]-5-fluoroaniline
CID 63591138
3-(6-chloropyrimidin-4-yl)oxyaniline
CID 95928501
N-[(3-aminophenyl)methyl]-6-ethoxy-N-ethylpyridin-2-amine
CID 63591322
2-ethoxy-6-(3-ethylphenoxy)pyridin-3-amine
CID 43262375
4-[(6-ethoxy-2-pyridinyl)sulfanyl]aniline
CID 63589015

Frequently Asked Questions

What is the IUPAC name of 3-[(6-ethoxy-2-pyridinyl)oxy]aniline?
The IUPAC name of 3-[(6-ethoxy-2-pyridinyl)oxy]aniline (CID 63591311) is 3-[(6-ethoxy-2-pyridinyl)oxy]aniline.
What is the SMILES notation for 3-[(6-ethoxy-2-pyridinyl)oxy]aniline?
The canonical SMILES for 3-[(6-ethoxy-2-pyridinyl)oxy]aniline is CCOc1cccc(Oc2cccc(N)c2)n1.
What is the InChIKey of 3-[(6-ethoxy-2-pyridinyl)oxy]aniline?
The InChIKey is VTAUXZPVQLCLQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-2-16-12-7-4-8-13(15-12)17-11-6-3-5-10(14)9-11/h3-9H,2,14H2,1H3.
What are the key properties of 3-[(6-ethoxy-2-pyridinyl)oxy]aniline?
3-[(6-ethoxy-2-pyridinyl)oxy]aniline has a molecular weight of 230.27 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-ethoxy-2-pyridinyl)oxy]aniline is sourced from PubChem (CID 63591311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).