[(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine

C6H11F3N2O3S — CID 155354463

IUPAC[(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine
SMILESNC[C@H]1CN(S(=O)(=O)C(F)(F)F)CCO1
InChIInChI=1S/C6H11F3N2O3S/c7-6(8,9)15(12,13)11-1-2-14-5(3-10)4-11/h5H,1-4,10H2/t5-/m0/s1
InChIKeyAZGMMXGIPKHZMT-YFKPBYRVSA-N
MW248.23 g/mol
LogP-0.50
Rot. Bonds2

About [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine

[(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine (PubChem CID 155354463) has the molecular formula C6H11F3N2O3S and a molecular weight of 248.23 g/mol. Its IUPAC name is [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine
PubChem CID155354463
Molecular FormulaC6H11F3N2O3S
Molecular Weight248.23 g/mol
Exact Mass248.04
IUPAC Name[(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine
SMILESNC[C@H]1CN(S(=O)(=O)C(F)(F)F)CCO1
InChIInChI=1S/C6H11F3N2O3S/c7-6(8,9)15(12,13)11-1-2-14-5(3-10)4-11/h5H,1-4,10H2/t5-/m0/s1
InChIKeyAZGMMXGIPKHZMT-YFKPBYRVSA-N
XLogP-0.50
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.23
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine?
The IUPAC name of [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine (CID 155354463) is [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine.
What is the SMILES notation for [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine?
The canonical SMILES for [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine is NC[C@H]1CN(S(=O)(=O)C(F)(F)F)CCO1.
What is the InChIKey of [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine?
The InChIKey is AZGMMXGIPKHZMT-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H11F3N2O3S/c7-6(8,9)15(12,13)11-1-2-14-5(3-10)4-11/h5H,1-4,10H2/t5-/m0/s1.
What are the key properties of [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine?
[(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine has a molecular weight of 248.23 g/mol, XLogP of -0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-4-(trifluoromethylsulfonyl)morpholin-2-yl]methanamine is sourced from PubChem (CID 155354463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).