2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol

C10H8FNOS — CID 130501430

IUPAC2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol
SMILESOc1csc(Cc2ccc(F)cc2)n1
InChIInChI=1S/C10H8FNOS/c11-8-3-1-7(2-4-8)5-10-12-9(13)6-14-10/h1-4,6,13H,5H2
InChIKeyUQHSQKKDCZJWRH-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.58
Rot. Bonds2

About 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol

2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol (PubChem CID 130501430) has the molecular formula C10H8FNOS and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol
PubChem CID130501430
Molecular FormulaC10H8FNOS
Molecular Weight209.25 g/mol
Exact Mass209.03
IUPAC Name2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol
SMILESOc1csc(Cc2ccc(F)cc2)n1
InChIInChI=1S/C10H8FNOS/c11-8-3-1-7(2-4-8)5-10-12-9(13)6-14-10/h1-4,6,13H,5H2
InChIKeyUQHSQKKDCZJWRH-UHFFFAOYSA-N
XLogP2.58
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-fluorophenyl)sulfanylmethyl]-1,3-thiazol-4-ol
CID 130501476
2-[(4-fluorophenyl)methyl]-4-phenyl-1,3-thiazole
CID 47173323
methyl 2-[(4-fluorophenyl)methyl]-1,3-thiazole-4-carboxylate
CID 78918624
2-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]-2-methylpropanoic acid
CID 113369833
methyl 2-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]acetate
CID 94276829
4-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]-4-hydroxy-2-oxobut-3-enoic acid
CID 69142445
2-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]benzoic acid
CID 176901735
2-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]-N-[2-(methylamino)ethyl]acetamide
CID 119501988
4-[[4-(4-hydroxyphenyl)-1,3-thiazol-2-yl]methyl]phenol
CID 53391458
3-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]benzenesulfonamide
CID 10450423
2-[2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-yl]-N-pyridin-4-ylacetamide
CID 48673152
(2R)-1-[2-[(4-fluorophenyl)methyl]-1,3-thiazole-4-carbonyl]pyrrolidine-2-carboxylic acid
CID 119371189

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol?
The IUPAC name of 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol (CID 130501430) is 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol.
What is the SMILES notation for 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol?
The canonical SMILES for 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol is Oc1csc(Cc2ccc(F)cc2)n1.
What is the InChIKey of 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol?
The InChIKey is UQHSQKKDCZJWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNOS/c11-8-3-1-7(2-4-8)5-10-12-9(13)6-14-10/h1-4,6,13H,5H2.
What are the key properties of 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol?
2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol has a molecular weight of 209.25 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methyl]-1,3-thiazol-4-ol is sourced from PubChem (CID 130501430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).