(5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol

C10H8F3NO2S — CID 106782025

IUPAC(5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESCc1ccc(C(O)c2cnc(C(F)(F)F)s2)o1
InChIInChI=1S/C10H8F3NO2S/c1-5-2-3-6(16-5)8(15)7-4-14-9(17-7)10(11,12)13/h2-4,8,15H,1H3
InChIKeyXTIYYMZXEANWJY-UHFFFAOYSA-N
MW263.24 g/mol
LogP3.15
Rot. Bonds2

About (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol

(5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (PubChem CID 106782025) has the molecular formula C10H8F3NO2S and a molecular weight of 263.24 g/mol. Its IUPAC name is (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name(5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
PubChem CID106782025
Molecular FormulaC10H8F3NO2S
Molecular Weight263.24 g/mol
Exact Mass263.02
IUPAC Name(5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESCc1ccc(C(O)c2cnc(C(F)(F)F)s2)o1
InChIInChI=1S/C10H8F3NO2S/c1-5-2-3-6(16-5)8(15)7-4-14-9(17-7)10(11,12)13/h2-4,8,15H,1H3
InChIKeyXTIYYMZXEANWJY-UHFFFAOYSA-N
XLogP3.15
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.24
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (CID 106782025) is (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is Cc1ccc(C(O)c2cnc(C(F)(F)F)s2)o1.
What is the InChIKey of (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is XTIYYMZXEANWJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3NO2S/c1-5-2-3-6(16-5)8(15)7-4-14-9(17-7)10(11,12)13/h2-4,8,15H,1H3.
What are the key properties of (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
(5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 263.24 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylfuran-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 106782025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).