(1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol

C13H15NO2S — CID 63364307

IUPAC(1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol
SMILESCc1ncc(COc2ccc([C@@H](C)O)cc2)s1
InChIInChI=1S/C13H15NO2S/c1-9(15)11-3-5-12(6-4-11)16-8-13-7-14-10(2)17-13/h3-7,9,15H,8H2,1-2H3/t9-/m1/s1
InChIKeyIFBGVTINFMZPES-SECBINFHSA-N
MW249.33 g/mol
LogP3.08
Rot. Bonds4

About (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol

(1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol (PubChem CID 63364307) has the molecular formula C13H15NO2S and a molecular weight of 249.33 g/mol. Its IUPAC name is (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol
PubChem CID63364307
Molecular FormulaC13H15NO2S
Molecular Weight249.33 g/mol
Exact Mass249.08
IUPAC Name(1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol
SMILESCc1ncc(COc2ccc([C@@H](C)O)cc2)s1
InChIInChI=1S/C13H15NO2S/c1-9(15)11-3-5-12(6-4-11)16-8-13-7-14-10(2)17-13/h3-7,9,15H,8H2,1-2H3/t9-/m1/s1
InChIKeyIFBGVTINFMZPES-SECBINFHSA-N
XLogP3.08
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[[5-[(2-methyl-1,3-thiazol-5-yl)methoxy]-2-pyridinyl]methyl]propan-1-amine
CID 79793744
(1S)-1-[4-[(3,5-dimethylphenyl)methoxy]phenyl]ethanol
CID 78930281
1-[4-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]phenyl]ethanol
CID 43503686
3-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenol
CID 63020479
N-methyl-1-[3-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanamine
CID 63020641
N-[[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]methyl]propan-1-amine
CID 63020291
1-[3-methoxy-4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanamine
CID 63021499
1-[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]ethanol
CID 43503683
1-[4-(pyridin-3-ylmethoxy)phenyl]ethanol
CID 43503736
[2-methyl-5-[(2-methyl-1,3-thiazol-5-yl)methoxy]-1-benzofuran-3-yl]methanol
CID 178077313
3-[(2-methyl-1,3-thiazol-5-yl)methoxy]benzoic acid
CID 63019403
(1S)-1-[4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 78933376

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol (CID 63364307) is (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol is Cc1ncc(COc2ccc([C@@H](C)O)cc2)s1.
What is the InChIKey of (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol?
The InChIKey is IFBGVTINFMZPES-SECBINFHSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-9(15)11-3-5-12(6-4-11)16-8-13-7-14-10(2)17-13/h3-7,9,15H,8H2,1-2H3/t9-/m1/s1.
What are the key properties of (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol?
(1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol has a molecular weight of 249.33 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 63364307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).