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

C10H13F3N2OS — CID 106782199

IUPACpiperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESOC(c1cnc(C(F)(F)F)s1)C1CCCNC1
InChIInChI=1S/C10H13F3N2OS/c11-10(12,13)9-15-5-7(17-9)8(16)6-2-1-3-14-4-6/h5-6,8,14,16H,1-4H2
InChIKeyWUYXYPIWYWSIBH-UHFFFAOYSA-N
MW266.29 g/mol
LogP2.19
Rot. Bonds2

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

piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (PubChem CID 106782199) has the molecular formula C10H13F3N2OS and a molecular weight of 266.29 g/mol. Its IUPAC name is piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Namepiperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
PubChem CID106782199
Molecular FormulaC10H13F3N2OS
Molecular Weight266.29 g/mol
Exact Mass266.07
IUPAC Namepiperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol
SMILESOC(c1cnc(C(F)(F)F)s1)C1CCCNC1
InChIInChI=1S/C10H13F3N2OS/c11-10(12,13)9-15-5-7(17-9)8(16)6-2-1-3-14-4-6/h5-6,8,14,16H,1-4H2
InChIKeyWUYXYPIWYWSIBH-UHFFFAOYSA-N
XLogP2.19
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol (CID 106782199) is piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is OC(c1cnc(C(F)(F)F)s1)C1CCCNC1.
What is the InChIKey of piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
The InChIKey is WUYXYPIWYWSIBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2OS/c11-10(12,13)9-15-5-7(17-9)8(16)6-2-1-3-14-4-6/h5-6,8,14,16H,1-4H2.
What are the key properties of piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol?
piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol has a molecular weight of 266.29 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 106782199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).