[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol

C15H17NO3 — CID 80628736

IUPAC[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol
SMILESCCOc1ccccc1Oc1ncc(CO)cc1C
InChIInChI=1S/C15H17NO3/c1-3-18-13-6-4-5-7-14(13)19-15-11(2)8-12(10-17)9-16-15/h4-9,17H,3,10H2,1-2H3
InChIKeyROGHITPKZFWQQX-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.07
Rot. Bonds5

About [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol

[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol (PubChem CID 80628736) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol
PubChem CID80628736
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol
SMILESCCOc1ccccc1Oc1ncc(CO)cc1C
InChIInChI=1S/C15H17NO3/c1-3-18-13-6-4-5-7-14(13)19-15-11(2)8-12(10-17)9-16-15/h4-9,17H,3,10H2,1-2H3
InChIKeyROGHITPKZFWQQX-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol
CID 80628218
[6-(2,3-dichlorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80629406
(5-methyl-6-naphthalen-2-yloxy-3-pyridinyl)methanol
CID 80629021
[6-(2-bromo-4-fluorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80629216
[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628087
5-(bromomethyl)-3-methyl-2-(2-methylphenoxy)pyridine
CID 107087048
5-(chloromethyl)-3-methyl-2-(2-methylphenoxy)pyridine
CID 80628878
[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 80628637
[6-[3-(dimethylamino)phenoxy]-5-methyl-3-pyridinyl]methanol
CID 80628307
[5-methyl-6-(3-nitrophenoxy)-3-pyridinyl]methanol
CID 80629220
[6-(4-bromo-3-fluorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628936
[6-(2-chloro-5-nitrophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628217

Frequently Asked Questions

What is the IUPAC name of [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol?
The IUPAC name of [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol (CID 80628736) is [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol.
What is the SMILES notation for [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol?
The canonical SMILES for [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol is CCOc1ccccc1Oc1ncc(CO)cc1C.
What is the InChIKey of [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol?
The InChIKey is ROGHITPKZFWQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-3-18-13-6-4-5-7-14(13)19-15-11(2)8-12(10-17)9-16-15/h4-9,17H,3,10H2,1-2H3.
What are the key properties of [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol?
[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol has a molecular weight of 259.31 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol is sourced from PubChem (CID 80628736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).