4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol

C13H15NOS — CID 116886026

IUPAC4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol
SMILESCCCc1ccc(-c2nc(C)c(O)s2)cc1
InChIInChI=1S/C13H15NOS/c1-3-4-10-5-7-11(8-6-10)12-14-9(2)13(15)16-12/h5-8,15H,3-4H2,1-2H3
InChIKeyOSAOIIZCNSTUMN-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.78
Rot. Bonds3

About 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol

4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol (PubChem CID 116886026) has the molecular formula C13H15NOS and a molecular weight of 233.34 g/mol. Its IUPAC name is 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol.

Molecular Properties

Compound Name4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol
PubChem CID116886026
Molecular FormulaC13H15NOS
Molecular Weight233.34 g/mol
Exact Mass233.09
IUPAC Name4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol
SMILESCCCc1ccc(-c2nc(C)c(O)s2)cc1
InChIInChI=1S/C13H15NOS/c1-3-4-10-5-7-11(8-6-10)12-14-9(2)13(15)16-12/h5-8,15H,3-4H2,1-2H3
InChIKeyOSAOIIZCNSTUMN-UHFFFAOYSA-N
XLogP3.78
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 ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol?
The IUPAC name of 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol (CID 116886026) is 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol.
What is the SMILES notation for 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol?
The canonical SMILES for 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol is CCCc1ccc(-c2nc(C)c(O)s2)cc1.
What is the InChIKey of 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol?
The InChIKey is OSAOIIZCNSTUMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NOS/c1-3-4-10-5-7-11(8-6-10)12-14-9(2)13(15)16-12/h5-8,15H,3-4H2,1-2H3.
What are the key properties of 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol?
4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol has a molecular weight of 233.34 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-propylphenyl)-1,3-thiazol-5-ol is sourced from PubChem (CID 116886026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).