2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol

C14H13Cl2NO2 — CID 105084678

IUPAC2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol
SMILESCOc1ncccc1C(O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C14H13Cl2NO2/c1-19-14-9(4-3-7-17-14)13(18)8-10-11(15)5-2-6-12(10)16/h2-7,13,18H,8H2,1H3
InChIKeyYHTVMNUNARESQY-UHFFFAOYSA-N
MW298.17 g/mol
LogP3.67
Rot. Bonds4

About 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol

2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol (PubChem CID 105084678) has the molecular formula C14H13Cl2NO2 and a molecular weight of 298.17 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol
PubChem CID105084678
Molecular FormulaC14H13Cl2NO2
Molecular Weight298.17 g/mol
Exact Mass297.03
IUPAC Name2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol
SMILESCOc1ncccc1C(O)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C14H13Cl2NO2/c1-19-14-9(4-3-7-17-14)13(18)8-10-11(15)5-2-6-12(10)16/h2-7,13,18H,8H2,1H3
InChIKeyYHTVMNUNARESQY-UHFFFAOYSA-N
XLogP3.67
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.17
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-3-pyridinyl)-2-(1,3-thiazol-2-yl)ethanol
CID 105115288
2-(2,6-dichlorophenyl)-1-pyrimidin-2-ylethanol
CID 62606143
1-(2-methoxy-3-pyridinyl)hex-5-yn-1-ol
CID 105124708
1-(3-chloro-2-methylphenyl)-2-(2,6-dichlorophenyl)ethanol
CID 107103304
1-(2-methoxy-3-pyridinyl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanol
CID 105107858
2-cyclobutyl-1-(2-methoxy-3-pyridinyl)ethanol
CID 105100853
2-(2-bromo-5-fluorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol
CID 105088376
[2-(2,6-difluorophenyl)-1-(2-methoxy-3-pyridinyl)ethyl]hydrazine
CID 105342854
2,3-dihydroxy-3-(2-methoxy-3-pyridinyl)propanoic acid
CID 170823762
4-chloro-1-(2-methoxy-3-pyridinyl)butane-1,2-diol
CID 171893593
2-(2,6-dichlorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 103373585
1-(4-bromo-2-methoxyphenyl)-2-(2,6-dichlorophenyl)ethanol
CID 115782457

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol?
The IUPAC name of 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol (CID 105084678) is 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol?
The canonical SMILES for 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol is COc1ncccc1C(O)Cc1c(Cl)cccc1Cl.
What is the InChIKey of 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol?
The InChIKey is YHTVMNUNARESQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO2/c1-19-14-9(4-3-7-17-14)13(18)8-10-11(15)5-2-6-12(10)16/h2-7,13,18H,8H2,1H3.
What are the key properties of 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol?
2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol has a molecular weight of 298.17 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-1-(2-methoxy-3-pyridinyl)ethanol is sourced from PubChem (CID 105084678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).