[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol

C13H15NOS — CID 82428598

IUPAC[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol
SMILESCCc1nc(-c2cccc(C)c2)sc1CO
InChIInChI=1S/C13H15NOS/c1-3-11-12(8-15)16-13(14-11)10-6-4-5-9(2)7-10/h4-7,15H,3,8H2,1-2H3
InChIKeyYWAMDMYXVQSGQO-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.17
Rot. Bonds3

About [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol

[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol (PubChem CID 82428598) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol
PubChem CID82428598
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol
SMILESCCc1nc(-c2cccc(C)c2)sc1CO
InChIInChI=1S/C13H15NOS/c1-3-11-12(8-15)16-13(14-11)10-6-4-5-9(2)7-10/h4-7,15H,3,8H2,1-2H3
InChIKeyYWAMDMYXVQSGQO-UHFFFAOYSA-N
XLogP3.17
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-2-(3-methylphenyl)-1,3-thiazole-5-carbothioamide
CID 82428610
2-[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]propan-2-amine
CID 82428618
[5-(hydroxymethyl)-2-phenyl-1,3-thiazol-4-yl]methanol
CID 13435383
N-[[4-ethyl-2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methyl]ethanamine
CID 104841335
2-(3-methylphenyl)-1,3-thiazole-4,5-diol
CID 174799020
3-[4-(methoxymethyl)-2-(3-methylphenyl)-1,3-thiazol-5-yl]propanoic acid
CID 82440255
N-[[4-ethyl-2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 82430015
[2-(3-methylphenyl)-5-phenyl-1,3-thiazol-4-yl]methanamine
CID 64716446
2-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]butan-1-ol
CID 116887170
4-[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]butan-2-one
CID 116886466
5-[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]-3H-1,3,4-oxadiazole-2-thione
CID 82428626
[5-ethyl-4-(3-methylphenyl)-1H-imidazol-2-yl]methanol
CID 105470026

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol (CID 82428598) is [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol is CCc1nc(-c2cccc(C)c2)sc1CO.
What is the InChIKey of [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is YWAMDMYXVQSGQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c1-3-11-12(8-15)16-13(14-11)10-6-4-5-9(2)7-10/h4-7,15H,3,8H2,1-2H3.
What are the key properties of [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol?
[4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 233.34 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 82428598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).