2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine

C10H19F3N2O — CID 64532686

IUPAC2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
SMILESCC(C)N1CCOC(CNCC(F)(F)F)C1
InChIInChI=1S/C10H19F3N2O/c1-8(2)15-3-4-16-9(6-15)5-14-7-10(11,12)13/h8-9,14H,3-7H2,1-2H3
InChIKeyVLXHGXWJMCAYAK-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.25
Rot. Bonds4

About 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine

2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine (PubChem CID 64532686) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
PubChem CID64532686
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
SMILESCC(C)N1CCOC(CNCC(F)(F)F)C1
InChIInChI=1S/C10H19F3N2O/c1-8(2)15-3-4-16-9(6-15)5-14-7-10(11,12)13/h8-9,14H,3-7H2,1-2H3
InChIKeyVLXHGXWJMCAYAK-UHFFFAOYSA-N
XLogP1.25
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-propan-2-yl-2-(2,2,2-trifluoroethyl)morpholine
CID 146614610
3-chloro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]butan-1-amine
CID 65024909
N-[(4-propan-2-ylmorpholin-2-yl)methyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 106212449
2-cyclopentyl-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
CID 64535316
2-N,2-N-dimethyl-1-N-[(4-propan-2-ylmorpholin-2-yl)methyl]propane-1,2-diamine
CID 64535121
N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 82723781
2,3-dimethyl-3-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-2-ol
CID 106189997
N-[(4-propan-2-ylmorpholin-2-yl)methyl]hexan-3-amine
CID 64532904
1-[[(4-propan-2-ylmorpholin-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 65109049
N-[(4-propan-2-ylmorpholin-2-yl)methyl]-4-(trifluoromethyl)aniline
CID 64534290
N-[(4-propan-2-ylmorpholin-2-yl)methyl]-2-thiomorpholin-4-ylethanamine
CID 106325494
4-[(4-propan-2-ylmorpholin-2-yl)methylamino]butanoic acid
CID 64534544

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine (CID 64532686) is 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine is CC(C)N1CCOC(CNCC(F)(F)F)C1.
What is the InChIKey of 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine?
The InChIKey is VLXHGXWJMCAYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-8(2)15-3-4-16-9(6-15)5-14-7-10(11,12)13/h8-9,14H,3-7H2,1-2H3.
What are the key properties of 2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine?
2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine has a molecular weight of 240.27 g/mol, XLogP of 1.25, 4 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-propan-2-ylmorpholin-2-yl)methyl]ethanamine is sourced from PubChem (CID 64532686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).