(1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol

C10H10F3N3OS — CID 106782249

IUPAC(1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESCc1nn(C)cc1C(O)c1cnc(C(F)(F)F)s1
InChIInChI=1S/C10H10F3N3OS/c1-5-6(4-16(2)15-5)8(17)7-3-14-9(18-7)10(11,12)13/h3-4,8,17H,1-2H3
InChIKeySRXTZYGLXOTVGA-UHFFFAOYSA-N
MW277.27 g/mol
LogP2.29
Rot. Bonds2

About (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol

(1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (PubChem CID 106782249) has the molecular formula C10H10F3N3OS and a molecular weight of 277.27 g/mol. Its IUPAC name is (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name(1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
PubChem CID106782249
Molecular FormulaC10H10F3N3OS
Molecular Weight277.27 g/mol
Exact Mass277.05
IUPAC Name(1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESCc1nn(C)cc1C(O)c1cnc(C(F)(F)F)s1
InChIInChI=1S/C10H10F3N3OS/c1-5-6(4-16(2)15-5)8(17)7-3-14-9(18-7)10(11,12)13/h3-4,8,17H,1-2H3
InChIKeySRXTZYGLXOTVGA-UHFFFAOYSA-N
XLogP2.29
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (CID 106782249) is (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is Cc1nn(C)cc1C(O)c1cnc(C(F)(F)F)s1.
What is the InChIKey of (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is SRXTZYGLXOTVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N3OS/c1-5-6(4-16(2)15-5)8(17)7-3-14-9(18-7)10(11,12)13/h3-4,8,17H,1-2H3.
What are the key properties of (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
(1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 277.27 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-dimethylpyrazol-4-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 106782249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).