1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol

C13H15NOS — CID 62651396

IUPAC1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol
SMILESCC(O)c1cnc(CCc2ccccc2)s1
InChIInChI=1S/C13H15NOS/c1-10(15)12-9-14-13(16-12)8-7-11-5-3-2-4-6-11/h2-6,9-10,15H,7-8H2,1H3
InChIKeyFIQSOOWPZPURDG-UHFFFAOYSA-N
MW233.34 g/mol
LogP2.98
Rot. Bonds4

About 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol

1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol (PubChem CID 62651396) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol
PubChem CID62651396
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol
SMILESCC(O)c1cnc(CCc2ccccc2)s1
InChIInChI=1S/C13H15NOS/c1-10(15)12-9-14-13(16-12)8-7-11-5-3-2-4-6-11/h2-6,9-10,15H,7-8H2,1H3
InChIKeyFIQSOOWPZPURDG-UHFFFAOYSA-N
XLogP2.98
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-(2-phenylethyl)-1,3-thiazole-5-carboxylate
CID 80572742
2-[5-(1-hydroxyethyl)-1,3-thiazol-2-yl]acetamide
CID 130942367
1-[2-(phenylmethoxymethyl)-1,3-thiazol-5-yl]ethanamine
CID 130949962
1-[2-(butan-2-ylsulfanylmethyl)-1,3-thiazol-5-yl]ethanol
CID 65141390
2-(2-phenylmethoxypropyl)-5-propan-2-yl-1,3-thiazole
CID 146604365
1-[2-(thian-4-ylmethyl)-1,3-thiazol-5-yl]ethanol
CID 115090169
butane-2,3-diol;2-phenylethanol
CID 175116943
N-[(5-methyl-1,3-thiazol-2-yl)methyl]-4-phenylbutan-2-amine
CID 103729859
5-[2-(2-phenylethyl)-1,3-thiazol-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione
CID 82425474
1-[2-(4-methylphenyl)-1,3-thiazol-5-yl]ethanol
CID 62651208
1-[1-(2-phenylethyl)pyrazol-4-yl]ethanol
CID 62731819
N-[(5-methyl-1,3-thiazol-2-yl)methyl]-2-phenylethanamine
CID 46784215

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol?
The IUPAC name of 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol (CID 62651396) is 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol is CC(O)c1cnc(CCc2ccccc2)s1.
What is the InChIKey of 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol?
The InChIKey is FIQSOOWPZPURDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c1-10(15)12-9-14-13(16-12)8-7-11-5-3-2-4-6-11/h2-6,9-10,15H,7-8H2,1H3.
What are the key properties of 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol?
1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol has a molecular weight of 233.34 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-phenylethyl)-1,3-thiazol-5-yl]ethanol is sourced from PubChem (CID 62651396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).