[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol

C13H14FNO2S — CID 113223111

IUPAC[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol
SMILESCc1ncsc1CCOc1ccc(F)cc1CO
InChIInChI=1S/C13H14FNO2S/c1-9-13(18-8-15-9)4-5-17-12-3-2-11(14)6-10(12)7-16/h2-3,6,8,16H,4-5,7H2,1H3
InChIKeyODAUOMUULAFRNP-UHFFFAOYSA-N
MW267.32 g/mol
LogP2.70
Rot. Bonds5

About [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol

[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol (PubChem CID 113223111) has the molecular formula C13H14FNO2S and a molecular weight of 267.32 g/mol. Its IUPAC name is [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol.

Molecular Properties

Compound Name[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol
PubChem CID113223111
Molecular FormulaC13H14FNO2S
Molecular Weight267.32 g/mol
Exact Mass267.07
IUPAC Name[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol
SMILESCc1ncsc1CCOc1ccc(F)cc1CO
InChIInChI=1S/C13H14FNO2S/c1-9-13(18-8-15-9)4-5-17-12-3-2-11(14)6-10(12)7-16/h2-3,6,8,16H,4-5,7H2,1H3
InChIKeyODAUOMUULAFRNP-UHFFFAOYSA-N
XLogP2.70
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]ethanamine
CID 43285209
5-[2-(2,5-dimethylphenoxy)ethyl]-4-methyl-1,3-thiazole
CID 79502670
3-fluoro-4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]benzenesulfonyl chloride
CID 82916083
[2-[2-(dimethylamino)ethoxy]-5-fluorophenyl]methanol
CID 107698691
(5-fluoro-2-hexoxyphenyl)methanol
CID 91657337
[5-fluoro-2-(2-methylsulfanylethoxy)phenyl]methanol
CID 107698407
N-[(2,5-difluorophenyl)methyl]-2-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 55237246
N-[[5-chloro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methyl]propan-1-amine
CID 62070964
1-[4-methyl-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]ethanone
CID 63651606
5-[3-[4-fluoro-2-(hydroxymethyl)phenoxy]propyl]-4-methyl-1H-pyrazole-3-carbonitrile
CID 123948907
[5-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyrazin-2-yl]methanol
CID 107373137
1-[3-bromo-4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]propan-2-amine
CID 63050480

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol?
The IUPAC name of [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol (CID 113223111) is [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol.
What is the SMILES notation for [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol?
The canonical SMILES for [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol is Cc1ncsc1CCOc1ccc(F)cc1CO.
What is the InChIKey of [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol?
The InChIKey is ODAUOMUULAFRNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO2S/c1-9-13(18-8-15-9)4-5-17-12-3-2-11(14)6-10(12)7-16/h2-3,6,8,16H,4-5,7H2,1H3.
What are the key properties of [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol?
[5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol has a molecular weight of 267.32 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]phenyl]methanol is sourced from PubChem (CID 113223111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).