[6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol

C10H14F3N3O2S — CID 107305743

IUPAC[6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol
SMILESCC1(C)CN(c2nc(C(F)(F)F)ns2)CC(CO)O1
InChIInChI=1S/C10H14F3N3O2S/c1-9(2)5-16(3-6(4-17)18-9)8-14-7(15-19-8)10(11,12)13/h6,17H,3-5H2,1-2H3
InChIKeyGIGGXGXBYYUDQI-UHFFFAOYSA-N
MW297.30 g/mol
LogP1.53
Rot. Bonds2

About [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol

[6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol (PubChem CID 107305743) has the molecular formula C10H14F3N3O2S and a molecular weight of 297.30 g/mol. Its IUPAC name is [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol
PubChem CID107305743
Molecular FormulaC10H14F3N3O2S
Molecular Weight297.30 g/mol
Exact Mass297.08
IUPAC Name[6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol
SMILESCC1(C)CN(c2nc(C(F)(F)F)ns2)CC(CO)O1
InChIInChI=1S/C10H14F3N3O2S/c1-9(2)5-16(3-6(4-17)18-9)8-14-7(15-19-8)10(11,12)13/h6,17H,3-5H2,1-2H3
InChIKeyGIGGXGXBYYUDQI-UHFFFAOYSA-N
XLogP1.53
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.30
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-[3-(Trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol
CID 107305723
[5-Methyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol
CID 107305725
2-[1-[3-(Trifluoromethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]oxyethanol
CID 107305726
[4-[3-(Trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-3-yl]methanol
CID 107305737
[6-Methyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol
CID 107305754
(2S)-3-[(3-propan-2-yl-1,2,4-thiadiazol-5-yl)-(3,3,3-trifluoropropyl)amino]propane-1,2-diol
CID 111976999
4-[3-(Trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholine-2-carboxylic acid
CID 113943860
1-Methoxy-3-[methyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]propan-2-ol
CID 113944085
2-[2-[Methyl-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]ethoxy]ethanol
CID 114243532
1-[3-(Methoxymethyl)-1,2,4-thiadiazol-5-yl]-4-(trifluoromethyl)piperidin-4-ol
CID 136518258
[4-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)morpholin-2-yl]methanol
CID 79838968
[4-(3-Ethyl-1,2,4-thiadiazol-5-yl)morpholin-2-yl]methanol
CID 79839433

Frequently Asked Questions

What is the IUPAC name of [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol?
The IUPAC name of [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol (CID 107305743) is [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol.
What is the SMILES notation for [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol?
The canonical SMILES for [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol is CC1(C)CN(c2nc(C(F)(F)F)ns2)CC(CO)O1.
What is the InChIKey of [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol?
The InChIKey is GIGGXGXBYYUDQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3O2S/c1-9(2)5-16(3-6(4-17)18-9)8-14-7(15-19-8)10(11,12)13/h6,17H,3-5H2,1-2H3.
What are the key properties of [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol?
[6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol has a molecular weight of 297.30 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6,6-dimethyl-4-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]morpholin-2-yl]methanol is sourced from PubChem (CID 107305743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).