2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol

C15H17NO3 — CID 105066229

IUPAC2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
SMILESCOc1cccc(CC(O)c2ccncc2OC)c1
InChIInChI=1S/C15H17NO3/c1-18-12-5-3-4-11(8-12)9-14(17)13-6-7-16-10-15(13)19-2/h3-8,10,14,17H,9H2,1-2H3
InChIKeyASRYODGFHQWFJI-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.37
Rot. Bonds5

About 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol

2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol (PubChem CID 105066229) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
PubChem CID105066229
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
SMILESCOc1cccc(CC(O)c2ccncc2OC)c1
InChIInChI=1S/C15H17NO3/c1-18-12-5-3-4-11(8-12)9-14(17)13-6-7-16-10-15(13)19-2/h3-8,10,14,17H,9H2,1-2H3
InChIKeyASRYODGFHQWFJI-UHFFFAOYSA-N
XLogP2.37
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 ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-dichlorophenyl)-1-(3-methoxy-4-pyridinyl)ethanol
CID 105066235
2-(4-ethylphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
CID 105066190
1-(3-methoxyphenyl)-3-pyridin-4-ylpropan-2-ol
CID 62608080
2-(3-methoxyphenyl)-1-(2-methylphenyl)ethanol
CID 61262736
3-(3-methoxyphenyl)-2-(3-methyl-4-pyridinyl)propanoic acid
CID 104572423
1-(3-methoxy-4-pyridinyl)pentan-1-ol
CID 105066220
1-(5-fluoro-3-pyridinyl)-2-(3-methoxyphenyl)ethanol
CID 54966198
1-(3-chloro-4-pyridinyl)-2-(3-methoxyphenyl)-N-methylethanamine
CID 105133902
1-(2,4-dimethoxyphenyl)-3-pyridin-3-ylpropan-1-ol
CID 105096059
(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol
CID 105066374
1-(4-methoxy-3-methylphenyl)-2-(3-methoxyphenyl)ethanol
CID 61080511
1-(2,4-difluorophenyl)-2-(3-methoxyphenyl)ethanol
CID 61088668

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol?
The IUPAC name of 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol (CID 105066229) is 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol?
The canonical SMILES for 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol is COc1cccc(CC(O)c2ccncc2OC)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol?
The InChIKey is ASRYODGFHQWFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-18-12-5-3-4-11(8-12)9-14(17)13-6-7-16-10-15(13)19-2/h3-8,10,14,17H,9H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol?
2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol has a molecular weight of 259.31 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol is sourced from PubChem (CID 105066229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).