1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol

C14H14BrNO2 — CID 107284929

IUPAC1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol
SMILESCc1ccc(Br)cc1Oc1ccc(C(C)O)cn1
InChIInChI=1S/C14H14BrNO2/c1-9-3-5-12(15)7-13(9)18-14-6-4-11(8-16-14)10(2)17/h3-8,10,17H,1-2H3
InChIKeyONGMJLNWVZBWEB-UHFFFAOYSA-N
MW308.18 g/mol
LogP4.00
Rot. Bonds3

About 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol

1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol (PubChem CID 107284929) has the molecular formula C14H14BrNO2 and a molecular weight of 308.18 g/mol. Its IUPAC name is 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol
PubChem CID107284929
Molecular FormulaC14H14BrNO2
Molecular Weight308.18 g/mol
Exact Mass307.02
IUPAC Name1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol
SMILESCc1ccc(Br)cc1Oc1ccc(C(C)O)cn1
InChIInChI=1S/C14H14BrNO2/c1-9-3-5-12(15)7-13(9)18-14-6-4-11(8-16-14)10(2)17/h3-8,10,17H,1-2H3
InChIKeyONGMJLNWVZBWEB-UHFFFAOYSA-N
XLogP4.00
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[6-(5-bromo-2-methylphenoxy)-3-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

(1S)-1-[6-(5-fluoro-2-methylphenoxy)-3-pyridinyl]ethanol
CID 102989853
(1S)-1-[6-(4-bromo-3,5-dimethylphenoxy)-3-pyridinyl]ethanol
CID 107724994
1-[6-(4-bromo-3,5-dimethylphenoxy)-3-pyridinyl]ethanol
CID 107724992
6-(5-bromo-2-methylphenoxy)pyridin-3-amine
CID 107283348
2-(5-bromo-2-methylphenoxy)-5-(trifluoromethyl)pyridine
CID 66876057
1-[6-(4-bromo-2,5-dichlorophenoxy)-3-pyridinyl]ethanol
CID 107659083
(1S)-1-[4-(5-bromo-2-methylphenoxy)-3-fluorophenyl]ethanol
CID 107284879
(1R)-1-[4-(5-bromo-2-methylphenoxy)-3-fluorophenyl]ethanol
CID 107284914
1-[5-(5-bromo-2-methylphenoxy)-2-pyridinyl]ethanol
CID 107284882
[5-(5-bromo-2-methylphenoxy)pyrazin-2-yl]methanol
CID 107373261
(1R)-1-[6-(4-bromo-5-fluoro-2-nitrophenoxy)-3-pyridinyl]ethanol
CID 103483375
2-(5-bromo-2-methylphenoxy)pyrazine
CID 107284336

Frequently Asked Questions

What is the IUPAC name of 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol?
The IUPAC name of 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol (CID 107284929) is 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol.
What is the SMILES notation for 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol?
The canonical SMILES for 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol is Cc1ccc(Br)cc1Oc1ccc(C(C)O)cn1.
What is the InChIKey of 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol?
The InChIKey is ONGMJLNWVZBWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2/c1-9-3-5-12(15)7-13(9)18-14-6-4-11(8-16-14)10(2)17/h3-8,10,17H,1-2H3.
What are the key properties of 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol?
1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol has a molecular weight of 308.18 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(5-bromo-2-methylphenoxy)-3-pyridinyl]ethanol is sourced from PubChem (CID 107284929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).