N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine

C9H8F3NO — CID 74057330

IUPACN-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine
SMILESCON=Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C9H8F3NO/c1-14-13-6-7-2-4-8(5-3-7)9(10,11)12/h2-6H,1H3
InChIKeyZLAXDJDWMUZFPQ-UHFFFAOYSA-N
MW203.16 g/mol
LogP2.69
Rot. Bonds2

About N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine

N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine (PubChem CID 74057330) has the molecular formula C9H8F3NO and a molecular weight of 203.16 g/mol. Its IUPAC name is N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine.

Molecular Properties

Compound NameN-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine
PubChem CID74057330
Molecular FormulaC9H8F3NO
Molecular Weight203.16 g/mol
Exact Mass203.06
IUPAC NameN-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine
SMILESCON=Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C9H8F3NO/c1-14-13-6-7-2-4-8(5-3-7)9(10,11)12/h2-6H,1H3
InChIKeyZLAXDJDWMUZFPQ-UHFFFAOYSA-N
XLogP2.69
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.16
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methoxy-1-(4-methoxyphenyl)methanimine
CID 520640
N-methylsulfanyl-1-[4-(trifluoromethyl)phenyl]methanimine
CID 175162135
(E)-1-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]-N-methoxymethanimine
CID 43811221
N-(oxolan-2-yloxy)-1-[4-(trifluoromethyl)phenyl]methanimine
CID 175759950
methyl (2S)-2-methyl-3-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]oxypropanoate
CID 10913234
4-[(E)-[4-(trifluoromethyl)phenyl]methoxyiminomethyl]phenol
CID 135580355
(E)-1-(4-ethylphenyl)-N-methoxymethanimine
CID 89096123
N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-[(E)-methoxyiminomethyl]benzamide
CID 78778220
1-(trifluoromethyl)-4-[(E)-2-[4-(trifluoromethyl)phenyl]ethenyl]benzene
CID 11758889
[4-[(E)-methoxyiminomethyl]phenyl]-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methanone
CID 78772206
(5S)-5-(4-methoxyphenyl)-5-methyl-3-[(Z)-[4-(trifluoromethyl)phenyl]methylideneamino]imidazolidine-2,4-dione
CID 8003972
N-[(2-fluoro-4-methoxyphenyl)methylideneamino]-1-[4-(trifluoromethyl)phenyl]methanimine
CID 54461831

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine?
The IUPAC name of N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine (CID 74057330) is N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine.
What is the SMILES notation for N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine?
The canonical SMILES for N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine is CON=Cc1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine?
The InChIKey is ZLAXDJDWMUZFPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3NO/c1-14-13-6-7-2-4-8(5-3-7)9(10,11)12/h2-6H,1H3.
What are the key properties of N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine?
N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine has a molecular weight of 203.16 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1-[4-(trifluoromethyl)phenyl]methanimine is sourced from PubChem (CID 74057330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).