1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol

C14H16FNOS — CID 64770142

IUPAC1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol
SMILESCC(O)c1csc(C(C)(C)c2ccc(F)cc2)n1
InChIInChI=1S/C14H16FNOS/c1-9(17)12-8-18-13(16-12)14(2,3)10-4-6-11(15)7-5-10/h4-9,17H,1-3H3
InChIKeyCSQKMBVUNIFIPP-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.66
Rot. Bonds3

About 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol

1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol (PubChem CID 64770142) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol.

Molecular Properties

Compound Name1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol
PubChem CID64770142
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol
SMILESCC(O)c1csc(C(C)(C)c2ccc(F)cc2)n1
InChIInChI=1S/C14H16FNOS/c1-9(17)12-8-18-13(16-12)14(2,3)10-4-6-11(15)7-5-10/h4-9,17H,1-3H3
InChIKeyCSQKMBVUNIFIPP-UHFFFAOYSA-N
XLogP3.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol?
The IUPAC name of 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol (CID 64770142) is 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol.
What is the SMILES notation for 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol?
The canonical SMILES for 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol is CC(O)c1csc(C(C)(C)c2ccc(F)cc2)n1.
What is the InChIKey of 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol?
The InChIKey is CSQKMBVUNIFIPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-9(17)12-8-18-13(16-12)14(2,3)10-4-6-11(15)7-5-10/h4-9,17H,1-3H3.
What are the key properties of 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol?
1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol has a molecular weight of 265.35 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(4-fluorophenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanol is sourced from PubChem (CID 64770142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).