5-methyl-2-phenyl-1,3-thiazol-4-ol

C10H9NOS — CID 12583731

IUPAC5-methyl-2-phenyl-1,3-thiazol-4-ol
SMILESCc1sc(-c2ccccc2)nc1O
InChIInChI=1S/C10H9NOS/c1-7-9(12)11-10(13-7)8-5-3-2-4-6-8/h2-6,12H,1H3
InChIKeyGEBCXCJPRRWDBA-UHFFFAOYSA-N
MW191.25 g/mol
LogP2.82
Rot. Bonds1

About 5-methyl-2-phenyl-1,3-thiazol-4-ol

5-methyl-2-phenyl-1,3-thiazol-4-ol (PubChem CID 12583731) has the molecular formula C10H9NOS and a molecular weight of 191.25 g/mol. Its IUPAC name is 5-methyl-2-phenyl-1,3-thiazol-4-ol.

Molecular Properties

Compound Name5-methyl-2-phenyl-1,3-thiazol-4-ol
PubChem CID12583731
Molecular FormulaC10H9NOS
Molecular Weight191.25 g/mol
Exact Mass191.04
IUPAC Name5-methyl-2-phenyl-1,3-thiazol-4-ol
SMILESCc1sc(-c2ccccc2)nc1O
InChIInChI=1S/C10H9NOS/c1-7-9(12)11-10(13-7)8-5-3-2-4-6-8/h2-6,12H,1H3
InChIKeyGEBCXCJPRRWDBA-UHFFFAOYSA-N
XLogP2.82
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.25
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-phenyl-1,3-thiazol-4-ol?
The IUPAC name of 5-methyl-2-phenyl-1,3-thiazol-4-ol (CID 12583731) is 5-methyl-2-phenyl-1,3-thiazol-4-ol.
What is the SMILES notation for 5-methyl-2-phenyl-1,3-thiazol-4-ol?
The canonical SMILES for 5-methyl-2-phenyl-1,3-thiazol-4-ol is Cc1sc(-c2ccccc2)nc1O.
What is the InChIKey of 5-methyl-2-phenyl-1,3-thiazol-4-ol?
The InChIKey is GEBCXCJPRRWDBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS/c1-7-9(12)11-10(13-7)8-5-3-2-4-6-8/h2-6,12H,1H3.
What are the key properties of 5-methyl-2-phenyl-1,3-thiazol-4-ol?
5-methyl-2-phenyl-1,3-thiazol-4-ol has a molecular weight of 191.25 g/mol, XLogP of 2.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-phenyl-1,3-thiazol-4-ol is sourced from PubChem (CID 12583731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).