(2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol

C7H12F3NOS — CID 1484901

IUPAC(2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol
SMILESO[C@H](CN1CCSCC1)C(F)(F)F
InChIInChI=1S/C7H12F3NOS/c8-7(9,10)6(12)5-11-1-3-13-4-2-11/h6,12H,1-5H2/t6-/m1/s1
InChIKeyVULXDDBOUZXLRM-ZCFIWIBFSA-N
MW215.24 g/mol
LogP0.96
Rot. Bonds2

About (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol

(2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol (PubChem CID 1484901) has the molecular formula C7H12F3NOS and a molecular weight of 215.24 g/mol. Its IUPAC name is (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol
PubChem CID1484901
Molecular FormulaC7H12F3NOS
Molecular Weight215.24 g/mol
Exact Mass215.06
IUPAC Name(2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol
SMILESO[C@H](CN1CCSCC1)C(F)(F)F
InChIInChI=1S/C7H12F3NOS/c8-7(9,10)6(12)5-11-1-3-13-4-2-11/h6,12H,1-5H2/t6-/m1/s1
InChIKeyVULXDDBOUZXLRM-ZCFIWIBFSA-N
XLogP0.96
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.24
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol 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

1,1,1-Trifluoro-3-(1,4-thiazinan-4-yl)-2-propanol
CID 3696368
(S)-3-(1,1-dioxo-1lambda6-thiomorpholin-4-yl)-1,1,1-trifluoro-propan-2-ol
CID 118276755
(2S)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol
CID 1484900
(2S)-1,1,1-trifluoro-3-thiomorpholin-4-ium-4-ylpropan-2-ol
CID 6987123
1,1,1-Trifluoro-3-(1-oxo-1,4-thiazinan-4-yl)propan-2-ol
CID 63899800
4-(3,3,3-Trifluoro-2-hydroxypropyl)-1lambda6-thiomorpholine-1,1-dione
CID 63900613
1,1,1-Trifluoro-3-(3-methylthiomorpholino)propan-2-ol
CID 64053391
3-(2,6-Dimethylthiomorpholin-4-yl)-1,1,1-trifluoropropan-2-ol
CID 64117222
(2S)-3-[2-tert-butylsulfanylethyl(methyl)amino]-1,1,1-trifluoropropan-2-ol
CID 100751375
(2R)-3-[2-tert-butylsulfanylethyl(methyl)amino]-1,1,1-trifluoropropan-2-ol
CID 100751382
3-(2-Ethylthiomorpholin-4-yl)-1,1,1-trifluoropropan-2-ol
CID 104568573
1,1,1-Trifluoro-3-(2-methylthiomorpholin-4-yl)propan-2-ol
CID 104709037

Frequently Asked Questions

What is the IUPAC name of (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol?
The IUPAC name of (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol (CID 1484901) is (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol.
What is the SMILES notation for (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol?
The canonical SMILES for (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol is O[C@H](CN1CCSCC1)C(F)(F)F.
What is the InChIKey of (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol?
The InChIKey is VULXDDBOUZXLRM-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H12F3NOS/c8-7(9,10)6(12)5-11-1-3-13-4-2-11/h6,12H,1-5H2/t6-/m1/s1.
What are the key properties of (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol?
(2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol has a molecular weight of 215.24 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,1,1-trifluoro-3-thiomorpholin-4-ylpropan-2-ol is sourced from PubChem (CID 1484901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).