2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine

C14H19F3N2O — CID 83962854

IUPAC2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine
SMILESFC(F)(F)CNCc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C14H19F3N2O/c15-14(16,17)11-18-9-12-1-3-13(4-2-12)10-19-5-7-20-8-6-19/h1-4,18H,5-11H2
InChIKeyUDOOYKMHKBZZGQ-UHFFFAOYSA-N
MW288.31 g/mol
LogP2.17
Rot. Bonds5

About 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine

2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine (PubChem CID 83962854) has the molecular formula C14H19F3N2O and a molecular weight of 288.31 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine
PubChem CID83962854
Molecular FormulaC14H19F3N2O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC Name2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine
SMILESFC(F)(F)CNCc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C14H19F3N2O/c15-14(16,17)11-18-9-12-1-3-13(4-2-12)10-19-5-7-20-8-6-19/h1-4,18H,5-11H2
InChIKeyUDOOYKMHKBZZGQ-UHFFFAOYSA-N
XLogP2.17
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(Trifluoromethyl)benzyl]piperazine
CID 2782803
4-((Morpholin-4-yl)methyl)benzonitrile
CID 216864
N-benzylmorpholine-4-carboxamide
CID 760018
3-Morpholin-4-ylmethyl-benzylamine
CID 6484182
4-Benzylmorpholine
CID 249546
4-Benzylmorpholine hydrochloride
CID 2849468
4-[[4-(4-Piperidin-1-ylbut-1-ynyl)phenyl]methyl]morpholine
CID 10193234
4-[4-[4-(Piperidin-1-ylmethyl)phenyl]but-3-ynyl]morpholine
CID 10236617
3-(2,4-difluorophenyl)-N-methyl-3-morpholin-4-ylpropan-1-amine
CID 54765676
(4-Benzylmorpholin-2-yl)methanamine
CID 2776360
2-(Morpholin-4-yl)-1-phenylethan-1-amine
CID 2814462
2-(Morpholin-4-yl)-2-phenylethan-1-amine
CID 3158583

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine (CID 83962854) is 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine is FC(F)(F)CNCc1ccc(CN2CCOCC2)cc1.
What is the InChIKey of 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine?
The InChIKey is UDOOYKMHKBZZGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O/c15-14(16,17)11-18-9-12-1-3-13(4-2-12)10-19-5-7-20-8-6-19/h1-4,18H,5-11H2.
What are the key properties of 2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine?
2,2,2-trifluoro-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine has a molecular weight of 288.31 g/mol, XLogP of 2.17, 5 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-(morpholin-4-ylmethyl)phenyl]methyl]ethanamine is sourced from PubChem (CID 83962854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).