1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine

C13H15F3N2O — CID 15121255

IUPAC1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine
SMILESC/C(=N\c1ccccc1C(F)(F)F)N1CCOCC1
InChIInChI=1S/C13H15F3N2O/c1-10(18-6-8-19-9-7-18)17-12-5-3-2-4-11(12)13(14,15)16/h2-5H,6-9H2,1H3/b17-10+
InChIKeyZSKDBPUOYHUBJD-LICLKQGHSA-N
MW272.27 g/mol
LogP3.09
Rot. Bonds1

About 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine

1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine (PubChem CID 15121255) has the molecular formula C13H15F3N2O and a molecular weight of 272.27 g/mol. Its IUPAC name is 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine.

Molecular Properties

Compound Name1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine
PubChem CID15121255
Molecular FormulaC13H15F3N2O
Molecular Weight272.27 g/mol
Exact Mass272.11
IUPAC Name1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine
SMILESC/C(=N\c1ccccc1C(F)(F)F)N1CCOCC1
InChIInChI=1S/C13H15F3N2O/c1-10(18-6-8-19-9-7-18)17-12-5-3-2-4-11(12)13(14,15)16/h2-5H,6-9H2,1H3/b17-10+
InChIKeyZSKDBPUOYHUBJD-LICLKQGHSA-N
XLogP3.09
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.27
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboximidothioate
CID 2804508
2,2-dimethyl-N'-[2-(trifluoromethyl)phenyl]propanimidamide
CID 15738788
1,2-bis(trifluoromethyl)benzene;oxolane
CID 158991746
[2-chloro-3-(trifluoromethyl)phenyl]-morpholin-4-ylmethanone
CID 164892562
ethyl (2Z)-2-morpholin-4-yl-2-[[2-(trifluoromethyl)phenyl]hydrazinylidene]acetate
CID 6517601
morpholin-4-yl-[1-[2-(trifluoromethyl)benzoyl]piperidin-3-yl]methanone
CID 55517643
morpholin-4-yl-[6-[2-(trifluoromethyl)anilino]pyridazin-3-yl]methanone
CID 109114740
3-(1-methylindol-3-yl)-1-morpholin-4-yl-3-[2-(trifluoromethyl)phenyl]propan-1-one
CID 42804519
morpholin-4-yl-[4-[2-(trifluoromethyl)phenyl]-5H-tetrazol-1-yl]methanone
CID 159943110
methyl 3-bromo-2-(1-morpholin-4-ylethylideneamino)-5-(trifluoromethyl)benzoate
CID 175992797
(1R,2R,4R)-2-(morpholine-4-carbonyl)-4-[2-(trifluoromethyl)phenyl]sulfonylcyclopentane-1-carboxamide
CID 70194940
(5R,6R)-4-methylidene-5-(morpholine-4-carbonyl)-6-[2-(trifluoromethyl)phenyl]-1,3-diazinan-2-one
CID 2377275

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine?
The IUPAC name of 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine (CID 15121255) is 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine.
What is the SMILES notation for 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine?
The canonical SMILES for 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine is C/C(=N\c1ccccc1C(F)(F)F)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine?
The InChIKey is ZSKDBPUOYHUBJD-LICLKQGHSA-N. The full InChI is InChI=1S/C13H15F3N2O/c1-10(18-6-8-19-9-7-18)17-12-5-3-2-4-11(12)13(14,15)16/h2-5H,6-9H2,1H3/b17-10+.
What are the key properties of 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine?
1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine has a molecular weight of 272.27 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-N-[2-(trifluoromethyl)phenyl]ethanimine is sourced from PubChem (CID 15121255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).