(1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol

C15H17NO2 — CID 83125032

IUPAC(1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol
SMILESCc1ccc(Oc2ccc([C@H](C)O)nc2)c(C)c1
InChIInChI=1S/C15H17NO2/c1-10-4-7-15(11(2)8-10)18-13-5-6-14(12(3)17)16-9-13/h4-9,12,17H,1-3H3/t12-/m0/s1
InChIKeyHHMHFWBOLUHHQE-LBPRGKRZSA-N
MW243.31 g/mol
LogP3.54
Rot. Bonds3

About (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol

(1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol (PubChem CID 83125032) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol
PubChem CID83125032
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name(1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol
SMILESCc1ccc(Oc2ccc([C@H](C)O)nc2)c(C)c1
InChIInChI=1S/C15H17NO2/c1-10-4-7-15(11(2)8-10)18-13-5-6-14(12(3)17)16-9-13/h4-9,12,17H,1-3H3/t12-/m0/s1
InChIKeyHHMHFWBOLUHHQE-LBPRGKRZSA-N
XLogP3.54
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[5-(4-methyl-2-nitrophenoxy)-2-pyridinyl]ethanol
CID 83124582
1-[5-(5-bromo-2-methylphenoxy)-2-pyridinyl]ethanol
CID 107284882
1-[5-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-2-pyridinyl]ethanol
CID 83110707
(1R)-1-[5-(4-chloro-2,6-dimethylphenoxy)-2-pyridinyl]ethanol
CID 83124719
(1R)-1-[5-[(2-methyl-3-pyridinyl)oxy]-2-pyridinyl]ethanol
CID 83125304
1-[5-(2-bromo-4-fluorophenoxy)-2-pyridinyl]ethanol
CID 83125031
(1S)-1-[5-(2-methoxyphenoxy)-2-pyridinyl]ethanol
CID 83124880
1-[5-[4-(hydroxymethyl)-2-methoxyphenoxy]-2-pyridinyl]ethanol
CID 107743552
1-[5-(2-methoxy-4-methylphenoxy)-2-pyridinyl]propan-1-ol
CID 115940517
1-[5-(2-methoxy-4-methylphenoxy)-2-pyridinyl]ethanamine
CID 83127673
(1R)-1-[5-(2-methylquinolin-8-yl)oxy-2-pyridinyl]ethanol
CID 83110709
(1S)-1-[5-(2-methylquinolin-8-yl)oxy-2-pyridinyl]ethanol
CID 83111455

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol?
The IUPAC name of (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol (CID 83125032) is (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol.
What is the SMILES notation for (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol?
The canonical SMILES for (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol is Cc1ccc(Oc2ccc([C@H](C)O)nc2)c(C)c1.
What is the InChIKey of (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol?
The InChIKey is HHMHFWBOLUHHQE-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H17NO2/c1-10-4-7-15(11(2)8-10)18-13-5-6-14(12(3)17)16-9-13/h4-9,12,17H,1-3H3/t12-/m0/s1.
What are the key properties of (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol?
(1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol has a molecular weight of 243.31 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[5-(2,4-dimethylphenoxy)-2-pyridinyl]ethanol is sourced from PubChem (CID 83125032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).