1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol

C15H17NO3 — CID 83124813

IUPAC1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol
SMILESCCOc1cccc(Oc2ccc(C(C)O)nc2)c1
InChIInChI=1S/C15H17NO3/c1-3-18-12-5-4-6-13(9-12)19-14-7-8-15(11(2)17)16-10-14/h4-11,17H,3H2,1-2H3
InChIKeyPYDWCXFJMDRTOV-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.33
Rot. Bonds5

About 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol

1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol (PubChem CID 83124813) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol
PubChem CID83124813
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol
SMILESCCOc1cccc(Oc2ccc(C(C)O)nc2)c1
InChIInChI=1S/C15H17NO3/c1-3-18-12-5-4-6-13(9-12)19-14-7-8-15(11(2)17)16-10-14/h4-11,17H,3H2,1-2H3
InChIKeyPYDWCXFJMDRTOV-UHFFFAOYSA-N
XLogP3.33
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[5-(3-ethoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939228
(1S)-1-[5-(3-tert-butylphenoxy)-2-pyridinyl]ethanol
CID 83125531
1-[5-(2-ethoxyphenoxy)-2-pyridinyl]ethanol
CID 83124644
(1R)-1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939075
1-[5-(3,5-dichlorophenoxy)-2-pyridinyl]ethanol
CID 83125125
1-[5-(3,4-difluorophenoxy)-2-pyridinyl]ethanol
CID 83125690
(1R)-1-(5-naphthalen-1-yloxy-2-pyridinyl)ethanol
CID 83125038
(1S)-1-[5-[4-(2-methoxyethyl)phenoxy]-2-pyridinyl]ethanol
CID 83124503
1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-amine
CID 112584748
1-(5-propoxy-2-pyridinyl)ethanol
CID 174643637
(1S)-1-[5-(3-chlorophenoxy)-2-pyridinyl]ethanamine
CID 83127697
(1S)-1-[5-(2-methoxyphenoxy)-2-pyridinyl]ethanol
CID 83124880

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol?
The IUPAC name of 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol (CID 83124813) is 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol.
What is the SMILES notation for 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol?
The canonical SMILES for 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol is CCOc1cccc(Oc2ccc(C(C)O)nc2)c1.
What is the InChIKey of 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol?
The InChIKey is PYDWCXFJMDRTOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-3-18-12-5-4-6-13(9-12)19-14-7-8-15(11(2)17)16-10-14/h4-11,17H,3H2,1-2H3.
What are the key properties of 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol?
1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol has a molecular weight of 259.31 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-ethoxyphenoxy)-2-pyridinyl]ethanol is sourced from PubChem (CID 83124813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).