2-phenyl-1-(1,2-thiazol-3-yl)ethanol

C11H11NOS — CID 130604788

IUPAC2-phenyl-1-(1,2-thiazol-3-yl)ethanol
SMILESOC(Cc1ccccc1)c1ccsn1
InChIInChI=1S/C11H11NOS/c13-11(10-6-7-14-12-10)8-9-4-2-1-3-5-9/h1-7,11,13H,8H2
InChIKeyIKAKLVUGAISGPR-UHFFFAOYSA-N
MW205.28 g/mol
LogP2.42
Rot. Bonds3

About 2-phenyl-1-(1,2-thiazol-3-yl)ethanol

2-phenyl-1-(1,2-thiazol-3-yl)ethanol (PubChem CID 130604788) has the molecular formula C11H11NOS and a molecular weight of 205.28 g/mol. Its IUPAC name is 2-phenyl-1-(1,2-thiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-phenyl-1-(1,2-thiazol-3-yl)ethanol
PubChem CID130604788
Molecular FormulaC11H11NOS
Molecular Weight205.28 g/mol
Exact Mass205.06
IUPAC Name2-phenyl-1-(1,2-thiazol-3-yl)ethanol
SMILESOC(Cc1ccccc1)c1ccsn1
InChIInChI=1S/C11H11NOS/c13-11(10-6-7-14-12-10)8-9-4-2-1-3-5-9/h1-7,11,13H,8H2
InChIKeyIKAKLVUGAISGPR-UHFFFAOYSA-N
XLogP2.42
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094110
[3-(4-Trifluoromethyl-phenyl)-isothiazol-5-yl]-methanol
CID 59212200
2-(3-(4-Fluorophenyl)isothiazol-5-yl)propan-2-ol
CID 68328241
1-[4-[5-(Trifluoromethyl)-1,2-thiazol-3-yl]phenyl]ethanol
CID 152078970
[5-[1-(3-Ethyl-2-fluorophenyl)propan-2-yl]-1,2-thiazol-3-yl]methanol
CID 170709310
[5-[1-(2-Fluoro-3-propan-2-ylphenyl)propan-2-yl]-1,2-thiazol-3-yl]methanol
CID 170709322
(3-Methyl-1,2-thiazol-5-yl)-phenylmethanol
CID 91620842
Isothiazolylphenylmethanol
CID 129752610
(2-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094109
(4-Fluorophenyl)-(1,2-thiazol-3-yl)methanol
CID 130731393
[2-Fluoro-4-(1,2-thiazol-3-yl)phenyl]methanol
CID 164643807
1-(5-Phenyl-1,2-thiazol-3-yl)butan-2-ol
CID 10353949

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(1,2-thiazol-3-yl)ethanol?
The IUPAC name of 2-phenyl-1-(1,2-thiazol-3-yl)ethanol (CID 130604788) is 2-phenyl-1-(1,2-thiazol-3-yl)ethanol.
What is the SMILES notation for 2-phenyl-1-(1,2-thiazol-3-yl)ethanol?
The canonical SMILES for 2-phenyl-1-(1,2-thiazol-3-yl)ethanol is OC(Cc1ccccc1)c1ccsn1.
What is the InChIKey of 2-phenyl-1-(1,2-thiazol-3-yl)ethanol?
The InChIKey is IKAKLVUGAISGPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NOS/c13-11(10-6-7-14-12-10)8-9-4-2-1-3-5-9/h1-7,11,13H,8H2.
What are the key properties of 2-phenyl-1-(1,2-thiazol-3-yl)ethanol?
2-phenyl-1-(1,2-thiazol-3-yl)ethanol has a molecular weight of 205.28 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(1,2-thiazol-3-yl)ethanol is sourced from PubChem (CID 130604788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).