1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol

C11H13NOS2 — CID 115091227

IUPAC1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol
SMILESCc1ccc(-c2ncc(CC(C)O)s2)s1
InChIInChI=1S/C11H13NOS2/c1-7(13)5-9-6-12-11(15-9)10-4-3-8(2)14-10/h3-4,6-7,13H,5H2,1-2H3
InChIKeyQHLSECIXRJZYAR-UHFFFAOYSA-N
MW239.36 g/mol
LogP3.10
Rot. Bonds3

About 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol

1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol (PubChem CID 115091227) has the molecular formula C11H13NOS2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol.

Molecular Properties

Compound Name1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol
PubChem CID115091227
Molecular FormulaC11H13NOS2
Molecular Weight239.36 g/mol
Exact Mass239.04
IUPAC Name1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol
SMILESCc1ccc(-c2ncc(CC(C)O)s2)s1
InChIInChI=1S/C11H13NOS2/c1-7(13)5-9-6-12-11(15-9)10-4-3-8(2)14-10/h3-4,6-7,13H,5H2,1-2H3
InChIKeyQHLSECIXRJZYAR-UHFFFAOYSA-N
XLogP3.10
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(4-methylphenyl)-1,3-thiazol-5-yl]propan-2-ol
CID 115091903
1-[2-(2-methylphenyl)-1,3-thiazol-5-yl]propan-2-ol
CID 115091825
1-(5-methylthiophen-2-yl)propan-2-ol
CID 13111508
1-[2-(5-bromothiophen-2-yl)-1,3-thiazol-5-yl]-N-methylpropan-2-amine
CID 115091295
1-[2-[(4-chlorophenyl)methyl]-1,3-thiazol-5-yl]propan-2-ol
CID 115091580
2-[[5-(2-hydroxypropyl)-1,3-thiazol-2-yl]methyl]phenol
CID 115091474
(2R)-1-(5-methylthiophen-2-yl)propan-2-amine
CID 18656698
1-[2-(4-bromophenyl)-1,3-thiazol-5-yl]propan-2-amine
CID 115091945
1-[2-(5-chlorothiophen-2-yl)-1,3-oxazol-5-yl]propan-2-ol
CID 115086475
1-(2-cyclohexyl-1,3-thiazol-5-yl)propan-2-ol
CID 115091994
(2S)-1-(2-methyl-1,3-thiazol-5-yl)propan-2-amine
CID 95426522
2-(3,5-dimethylphenyl)-5-(2-methylpropyl)-1,3-thiazole
CID 174954862

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol?
The IUPAC name of 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol (CID 115091227) is 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol.
What is the SMILES notation for 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol?
The canonical SMILES for 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol is Cc1ccc(-c2ncc(CC(C)O)s2)s1.
What is the InChIKey of 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol?
The InChIKey is QHLSECIXRJZYAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NOS2/c1-7(13)5-9-6-12-11(15-9)10-4-3-8(2)14-10/h3-4,6-7,13H,5H2,1-2H3.
What are the key properties of 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol?
1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol has a molecular weight of 239.36 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-methylthiophen-2-yl)-1,3-thiazol-5-yl]propan-2-ol is sourced from PubChem (CID 115091227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).