2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine

C10H13F3N2OS — CID 133365826

IUPAC2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
SMILESCC1CN(c2nc(C(F)(F)F)cs2)CC(C)O1
InChIInChI=1S/C10H13F3N2OS/c1-6-3-15(4-7(2)16-6)9-14-8(5-17-9)10(11,12)13/h5-7H,3-4H2,1-2H3
InChIKeyIDOYYAJXQLTXON-UHFFFAOYSA-N
MW266.29 g/mol
LogP2.78
Rot. Bonds1

About 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine

2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine (PubChem CID 133365826) has the molecular formula C10H13F3N2OS and a molecular weight of 266.29 g/mol. Its IUPAC name is 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
PubChem CID133365826
Molecular FormulaC10H13F3N2OS
Molecular Weight266.29 g/mol
Exact Mass266.07
IUPAC Name2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine
SMILESCC1CN(c2nc(C(F)(F)F)cs2)CC(C)O1
InChIInChI=1S/C10H13F3N2OS/c1-6-3-15(4-7(2)16-6)9-14-8(5-17-9)10(11,12)13/h5-7H,3-4H2,1-2H3
InChIKeyIDOYYAJXQLTXON-UHFFFAOYSA-N
XLogP2.78
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine (CID 133365826) is 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine is CC1CN(c2nc(C(F)(F)F)cs2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
The InChIKey is IDOYYAJXQLTXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2OS/c1-6-3-15(4-7(2)16-6)9-14-8(5-17-9)10(11,12)13/h5-7H,3-4H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine?
2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine has a molecular weight of 266.29 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine is sourced from PubChem (CID 133365826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).