1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol

C16H19NO2 — CID 106680148

IUPAC1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol
SMILESCOc1cc(C)cc(C)c1C(O)Cc1ccccn1
InChIInChI=1S/C16H19NO2/c1-11-8-12(2)16(15(9-11)19-3)14(18)10-13-6-4-5-7-17-13/h4-9,14,18H,10H2,1-3H3
InChIKeyBJYAIEINEPRTSD-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.98
Rot. Bonds4

About 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol

1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol (PubChem CID 106680148) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol.

Molecular Properties

Compound Name1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol
PubChem CID106680148
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol
SMILESCOc1cc(C)cc(C)c1C(O)Cc1ccccn1
InChIInChI=1S/C16H19NO2/c1-11-8-12(2)16(15(9-11)19-3)14(18)10-13-6-4-5-7-17-13/h4-9,14,18H,10H2,1-3H3
InChIKeyBJYAIEINEPRTSD-UHFFFAOYSA-N
XLogP2.98
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-4,6-dimethylphenyl)-N-methyl-2-pyridin-2-ylethanamine
CID 106680429
[1-(2-methoxy-4,6-dimethylphenyl)-3-pyridin-2-ylpropyl]hydrazine
CID 106682947
2-(3,5-dimethylphenyl)-1-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 106680174
1-(2-chloro-6-methoxyphenyl)-2-pyridin-2-ylethanol
CID 113456442
2-(3,4-difluorophenyl)-1-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 106682618
1-(2-methoxy-4,6-dimethylphenyl)-2-phenylsulfanylethanol
CID 106680203
1-(2-methoxy-4,6-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 106682653
1-(4-methoxy-2,5-dimethylphenyl)-3-pyridin-2-ylpropan-1-ol
CID 105124333
1-(2-methoxy-4,6-dimethylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 106680177
1,2-dipyridin-2-ylethanol
CID 11458306
1-(3-methoxypyrazin-2-yl)-2-pyridin-2-ylethanol
CID 104515074
pyridin-2-yl-(2,4,6-trimethylphenyl)methanol
CID 154106044

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol?
The IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol (CID 106680148) is 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol.
What is the SMILES notation for 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol?
The canonical SMILES for 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol is COc1cc(C)cc(C)c1C(O)Cc1ccccn1.
What is the InChIKey of 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol?
The InChIKey is BJYAIEINEPRTSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-11-8-12(2)16(15(9-11)19-3)14(18)10-13-6-4-5-7-17-13/h4-9,14,18H,10H2,1-3H3.
What are the key properties of 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol?
1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol has a molecular weight of 257.33 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4,6-dimethylphenyl)-2-pyridin-2-ylethanol is sourced from PubChem (CID 106680148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).