(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine

C6H10F3NO — CID 124508872

IUPAC(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine
SMILESC[C@@H]1CO[C@H](C(F)(F)F)CN1
InChIInChI=1S/C6H10F3NO/c1-4-3-11-5(2-10-4)6(7,8)9/h4-5,10H,2-3H2,1H3/t4-,5+/m1/s1
InChIKeyLUMNOIAAEIAHKT-UHNVWZDZSA-N
MW169.15 g/mol
LogP0.93
Rot. Bonds

About (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine

(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine (PubChem CID 124508872) has the molecular formula C6H10F3NO and a molecular weight of 169.15 g/mol. Its IUPAC name is (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine.

Molecular Properties

Compound Name(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine
PubChem CID124508872
Molecular FormulaC6H10F3NO
Molecular Weight169.15 g/mol
Exact Mass169.07
IUPAC Name(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine
SMILESC[C@@H]1CO[C@H](C(F)(F)F)CN1
InChIInChI=1S/C6H10F3NO/c1-4-3-11-5(2-10-4)6(7,8)9/h4-5,10H,2-3H2,1H3/t4-,5+/m1/s1
InChIKeyLUMNOIAAEIAHKT-UHNVWZDZSA-N
XLogP0.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-2-(trifluoromethyl)morpholine
CID 127013515
2-fluoro-5-methylmorpholine
CID 105427159
(2R,5S)-2,5-dimethylmorpholine
CID 641780
(5R)-5-methyl-2-(trifluoromethyl)oxane
CID 155244319
5-methylmorpholin-2-ol
CID 105427098
methyl 2-[6-(trifluoromethyl)morpholin-3-yl]acetate
CID 155970908
5-methyl-2-[4-(trifluoromethyl)phenyl]morpholine
CID 43367137
(2S,5S)-2-ethyl-5-methylmorpholine
CID 93264101
trimethyl-(5-methylmorpholin-2-yl)azanium
CID 68971801
3-ethyl-2-methyl-6-(trifluoromethyl)morpholine
CID 131021253
[(2R)-5-methylmorpholin-2-yl]methanol
CID 155273553
(2R,5S)-2-(4-fluorophenyl)-5-methylmorpholine;(5S)-2-(4-fluorophenyl)-5-methylmorpholine
CID 158378174

Frequently Asked Questions

What is the IUPAC name of (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine?
The IUPAC name of (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine (CID 124508872) is (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine.
What is the SMILES notation for (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine?
The canonical SMILES for (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine is C[C@@H]1CO[C@H](C(F)(F)F)CN1.
What is the InChIKey of (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine?
The InChIKey is LUMNOIAAEIAHKT-UHNVWZDZSA-N. The full InChI is InChI=1S/C6H10F3NO/c1-4-3-11-5(2-10-4)6(7,8)9/h4-5,10H,2-3H2,1H3/t4-,5+/m1/s1.
What are the key properties of (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine?
(2S,5R)-5-methyl-2-(trifluoromethyl)morpholine has a molecular weight of 169.15 g/mol, XLogP of 0.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5R)-5-methyl-2-(trifluoromethyl)morpholine is sourced from PubChem (CID 124508872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).