1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol

C12H13NOS — CID 115089425

IUPAC1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol
SMILESCC(O)Cc1csc(-c2ccccc2)n1
InChIInChI=1S/C12H13NOS/c1-9(14)7-11-8-15-12(13-11)10-5-3-2-4-6-10/h2-6,8-9,14H,7H2,1H3
InChIKeyHDFNUROPYPZUMT-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.73
Rot. Bonds3

About 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol

1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol (PubChem CID 115089425) has the molecular formula C12H13NOS and a molecular weight of 219.31 g/mol. Its IUPAC name is 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol
PubChem CID115089425
Molecular FormulaC12H13NOS
Molecular Weight219.31 g/mol
Exact Mass219.07
IUPAC Name1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol
SMILESCC(O)Cc1csc(-c2ccccc2)n1
InChIInChI=1S/C12H13NOS/c1-9(14)7-11-8-15-12(13-11)10-5-3-2-4-6-10/h2-6,8-9,14H,7H2,1H3
InChIKeyHDFNUROPYPZUMT-UHFFFAOYSA-N
XLogP2.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]propan-2-ol
CID 115089431
4-ethyl-2-phenyl-1,3-thiazole
CID 5324799
ethane;4-ethyl-2-phenyl-1,3-thiazole
CID 91427044
4-ethyl-2-phenyl-1,3-thiazole;dihydrochloride
CID 118514483
(2-phenyl-1,3-thiazol-4-yl)methanamine;dihydrochloride
CID 13196628
1-(4-hydroxy-2-methylpentyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]urea
CID 111455538
1-[2-(5-chlorofuran-2-yl)-1,3-thiazol-4-yl]propan-2-ol
CID 115089071
1-[4-[4-[(2-phenyl-1,3-thiazol-4-yl)methoxy]phenyl]phenyl]ethanol
CID 18956566
1-(4-hydroxy-2,2-dimethylpentyl)-3-[(2-phenyl-1,3-thiazol-4-yl)methyl]urea
CID 111506338
2-[(2-phenyl-1,3-thiazol-4-yl)methyl]nonanamide
CID 175903171
1-cyclopentyl-2-[(2-phenyl-1,3-thiazol-4-yl)methylamino]ethanol
CID 111425450
3-[ethyl-[(2-phenyl-1,3-thiazol-4-yl)methyl]amino]butanoic acid
CID 62828179

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol?
The IUPAC name of 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol (CID 115089425) is 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol.
What is the SMILES notation for 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol?
The canonical SMILES for 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol is CC(O)Cc1csc(-c2ccccc2)n1.
What is the InChIKey of 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol?
The InChIKey is HDFNUROPYPZUMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NOS/c1-9(14)7-11-8-15-12(13-11)10-5-3-2-4-6-10/h2-6,8-9,14H,7H2,1H3.
What are the key properties of 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol?
1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol has a molecular weight of 219.31 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenyl-1,3-thiazol-4-yl)propan-2-ol is sourced from PubChem (CID 115089425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).