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

C11H11NOS — CID 130604772

IUPAC1-phenyl-1-(1,2-thiazol-3-yl)ethanol
SMILESCC(O)(c1ccccc1)c1ccsn1
InChIInChI=1S/C11H11NOS/c1-11(13,10-7-8-14-12-10)9-5-3-2-4-6-9/h2-8,13H,1H3
InChIKeySLBARNFDBOJMJO-UHFFFAOYSA-N
MW205.28 g/mol
LogP2.40
Rot. Bonds2

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

1-phenyl-1-(1,2-thiazol-3-yl)ethanol (PubChem CID 130604772) has the molecular formula C11H11NOS and a molecular weight of 205.28 g/mol. Its IUPAC name is 1-phenyl-1-(1,2-thiazol-3-yl)ethanol.

Molecular Properties

Compound Name1-phenyl-1-(1,2-thiazol-3-yl)ethanol
PubChem CID130604772
Molecular FormulaC11H11NOS
Molecular Weight205.28 g/mol
Exact Mass205.06
IUPAC Name1-phenyl-1-(1,2-thiazol-3-yl)ethanol
SMILESCC(O)(c1ccccc1)c1ccsn1
InChIInChI=1S/C11H11NOS/c1-11(13,10-7-8-14-12-10)9-5-3-2-4-6-9/h2-8,13H,1H3
InChIKeySLBARNFDBOJMJO-UHFFFAOYSA-N
XLogP2.40
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Bis(4-chlorophenyl)-(1,2-thiazol-3-yl)methanol
CID 172447880
(4-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094110
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
(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
2-Methyl-1-(5-phenyl-1,2-thiazol-3-yl)propan-2-ol
CID 10421504
3-Phenyl-5-(1-hydroxybutyl)isothiazole
CID 19976910
(4-Methylphenyl)-(4-prop-2-enyl-1,2-thiazol-3-yl)methanol
CID 23510350

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-1-(1,2-thiazol-3-yl)ethanol?
The IUPAC name of 1-phenyl-1-(1,2-thiazol-3-yl)ethanol (CID 130604772) is 1-phenyl-1-(1,2-thiazol-3-yl)ethanol.
What is the SMILES notation for 1-phenyl-1-(1,2-thiazol-3-yl)ethanol?
The canonical SMILES for 1-phenyl-1-(1,2-thiazol-3-yl)ethanol is CC(O)(c1ccccc1)c1ccsn1.
What is the InChIKey of 1-phenyl-1-(1,2-thiazol-3-yl)ethanol?
The InChIKey is SLBARNFDBOJMJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NOS/c1-11(13,10-7-8-14-12-10)9-5-3-2-4-6-9/h2-8,13H,1H3.
What are the key properties of 1-phenyl-1-(1,2-thiazol-3-yl)ethanol?
1-phenyl-1-(1,2-thiazol-3-yl)ethanol has a molecular weight of 205.28 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-1-(1,2-thiazol-3-yl)ethanol is sourced from PubChem (CID 130604772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).