4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine

C10H13F3N2OS — CID 174638142

IUPAC4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
SMILESCCc1sc(N2CCOCC2)nc1C(F)(F)F
InChIInChI=1S/C10H13F3N2OS/c1-2-7-8(10(11,12)13)14-9(17-7)15-3-5-16-6-4-15/h2-6H2,1H3
InChIKeyZRIKMZJMDXKZIN-UHFFFAOYSA-N
MW266.29 g/mol
LogP2.56
Rot. Bonds2

About 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine

4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine (PubChem CID 174638142) has the molecular formula C10H13F3N2OS and a molecular weight of 266.29 g/mol. Its IUPAC name is 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine.

Molecular Properties

Compound Name4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
PubChem CID174638142
Molecular FormulaC10H13F3N2OS
Molecular Weight266.29 g/mol
Exact Mass266.07
IUPAC Name4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
SMILESCCc1sc(N2CCOCC2)nc1C(F)(F)F
InChIInChI=1S/C10H13F3N2OS/c1-2-7-8(10(11,12)13)14-9(17-7)15-3-5-16-6-4-15/h2-6H2,1H3
InChIKeyZRIKMZJMDXKZIN-UHFFFAOYSA-N
XLogP2.56
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The IUPAC name of 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine (CID 174638142) is 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine.
What is the SMILES notation for 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The canonical SMILES for 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine is CCc1sc(N2CCOCC2)nc1C(F)(F)F.
What is the InChIKey of 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The InChIKey is ZRIKMZJMDXKZIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2OS/c1-2-7-8(10(11,12)13)14-9(17-7)15-3-5-16-6-4-15/h2-6H2,1H3.
What are the key properties of 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine has a molecular weight of 266.29 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine is sourced from PubChem (CID 174638142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).