2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide

C10H17F3N2O2 — CID 62490413

IUPAC2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
SMILESCC(C)(CNC(=O)C(F)(F)F)N1CCOCC1
InChIInChI=1S/C10H17F3N2O2/c1-9(2,15-3-5-17-6-4-15)7-14-8(16)10(11,12)13/h3-7H2,1-2H3,(H,14,16)
InChIKeyBUEWMXHYIBQPKW-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.78
Rot. Bonds3

About 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide

2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide (PubChem CID 62490413) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
PubChem CID62490413
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
SMILESCC(C)(CNC(=O)C(F)(F)F)N1CCOCC1
InChIInChI=1S/C10H17F3N2O2/c1-9(2,15-3-5-17-6-4-15)7-14-8(16)10(11,12)13/h3-7H2,1-2H3,(H,14,16)
InChIKeyBUEWMXHYIBQPKW-UHFFFAOYSA-N
XLogP0.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.78
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-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide (CID 62490413) is 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide is CC(C)(CNC(=O)C(F)(F)F)N1CCOCC1.
What is the InChIKey of 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
The InChIKey is BUEWMXHYIBQPKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-9(2,15-3-5-17-6-4-15)7-14-8(16)10(11,12)13/h3-7H2,1-2H3,(H,14,16).
What are the key properties of 2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide?
2,2,2-trifluoro-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide has a molecular weight of 254.25 g/mol, XLogP of 0.78, 3 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-(2-methyl-2-morpholin-4-ylpropyl)acetamide is sourced from PubChem (CID 62490413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).