2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide

C8H13F3N2O2 — CID 78917066

IUPAC2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide
SMILESCN1CCOC(CNC(=O)C(F)(F)F)C1
InChIInChI=1S/C8H13F3N2O2/c1-13-2-3-15-6(5-13)4-12-7(14)8(9,10)11/h6H,2-5H2,1H3,(H,12,14)
InChIKeyNCDSTYJDXMTVGJ-UHFFFAOYSA-N
MW226.20 g/mol
LogP-0.00
Rot. Bonds2

About 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide

2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide (PubChem CID 78917066) has the molecular formula C8H13F3N2O2 and a molecular weight of 226.20 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide
PubChem CID78917066
Molecular FormulaC8H13F3N2O2
Molecular Weight226.20 g/mol
Exact Mass226.09
IUPAC Name2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide
SMILESCN1CCOC(CNC(=O)C(F)(F)F)C1
InChIInChI=1S/C8H13F3N2O2/c1-13-2-3-15-6(5-13)4-12-7(14)8(9,10)11/h6H,2-5H2,1H3,(H,12,14)
InChIKeyNCDSTYJDXMTVGJ-UHFFFAOYSA-N
XLogP-0.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.20
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide (CID 78917066) is 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide is CN1CCOC(CNC(=O)C(F)(F)F)C1.
What is the InChIKey of 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide?
The InChIKey is NCDSTYJDXMTVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F3N2O2/c1-13-2-3-15-6(5-13)4-12-7(14)8(9,10)11/h6H,2-5H2,1H3,(H,12,14).
What are the key properties of 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide?
2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide has a molecular weight of 226.20 g/mol, XLogP of -0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[(4-methylmorpholin-2-yl)methyl]acetamide is sourced from PubChem (CID 78917066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).