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

C14H10F3N — CID 11747016

IUPACN-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine
SMILESFC(F)(F)c1ccc(/C=N/c2ccccc2)cc1
InChIInChI=1S/C14H10F3N/c15-14(16,17)12-8-6-11(7-9-12)10-18-13-4-2-1-3-5-13/h1-10H/b18-10+
InChIKeyCRXNASHBGWAMAY-VCHYOVAHSA-N
MW249.24 g/mol
LogP4.46
Rot. Bonds2

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

N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine (PubChem CID 11747016) has the molecular formula C14H10F3N and a molecular weight of 249.24 g/mol. Its IUPAC name is N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine.

Molecular Properties

Compound NameN-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine
PubChem CID11747016
Molecular FormulaC14H10F3N
Molecular Weight249.24 g/mol
Exact Mass249.08
IUPAC NameN-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine
SMILESFC(F)(F)c1ccc(/C=N/c2ccccc2)cc1
InChIInChI=1S/C14H10F3N/c15-14(16,17)12-8-6-11(7-9-12)10-18-13-4-2-1-3-5-13/h1-10H/b18-10+
InChIKeyCRXNASHBGWAMAY-VCHYOVAHSA-N
XLogP4.46
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.24
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-benzylideneaniline N-oxide
CID 3036381
N-Benzylideneaniline
CID 10858
N-benzylidene-4-methylaniline
CID 75276
N-(4-Methylbenzylidene)-P-toluidine
CID 525721
Morphanthridine
CID 10878016
N-phenyl-N-[(1Z,2E)-3-phenylprop-2-en-1-ylidene]amine oxide
CID 5991124
N,1-diphenylmethanimine oxide
CID 6508552
N,N'-Terephthalylidenebis(4-butylaniline)
CID 141503
N,N'-Terephthalylidene-bis(4-fluoroaniline)
CID 321189
N-Cinnamylideneaniline
CID 5375816
N-(4-Methylbenzylidene)aniline
CID 525732
N,1-diphenylethan-1-imine
CID 555698

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine?
The IUPAC name of N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine (CID 11747016) is N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine.
What is the SMILES notation for N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine?
The canonical SMILES for N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine is FC(F)(F)c1ccc(/C=N/c2ccccc2)cc1.
What is the InChIKey of N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine?
The InChIKey is CRXNASHBGWAMAY-VCHYOVAHSA-N. The full InChI is InChI=1S/C14H10F3N/c15-14(16,17)12-8-6-11(7-9-12)10-18-13-4-2-1-3-5-13/h1-10H/b18-10+.
What are the key properties of N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine?
N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine has a molecular weight of 249.24 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-[4-(trifluoromethyl)phenyl]methanimine is sourced from PubChem (CID 11747016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).