2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine

C8H9F3N2OS — CID 66000677

IUPAC2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
SMILESFC(F)(F)c1csc(C2CNCCO2)n1
InChIInChI=1S/C8H9F3N2OS/c9-8(10,11)6-4-15-7(13-6)5-3-12-1-2-14-5/h4-5,12H,1-3H2
InChIKeyPMQBGIMBCMRTLE-UHFFFAOYSA-N
MW238.23 g/mol
LogP1.82
Rot. Bonds1

About 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine

2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine (PubChem CID 66000677) has the molecular formula C8H9F3N2OS and a molecular weight of 238.23 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
PubChem CID66000677
Molecular FormulaC8H9F3N2OS
Molecular Weight238.23 g/mol
Exact Mass238.04
IUPAC Name2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
SMILESFC(F)(F)c1csc(C2CNCCO2)n1
InChIInChI=1S/C8H9F3N2OS/c9-8(10,11)6-4-15-7(13-6)5-3-12-1-2-14-5/h4-5,12H,1-3H2
InChIKeyPMQBGIMBCMRTLE-UHFFFAOYSA-N
XLogP1.82
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.23
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The IUPAC name of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine (CID 66000677) is 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine.
What is the SMILES notation for 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The canonical SMILES for 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine is FC(F)(F)c1csc(C2CNCCO2)n1.
What is the InChIKey of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The InChIKey is PMQBGIMBCMRTLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N2OS/c9-8(10,11)6-4-15-7(13-6)5-3-12-1-2-14-5/h4-5,12H,1-3H2.
What are the key properties of 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine has a molecular weight of 238.23 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine is sourced from PubChem (CID 66000677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).