(E)-1-phenyl-N-trityloxymethanimine

C26H21NO — CID 5382595

IUPAC(E)-1-phenyl-N-trityloxymethanimine
SMILESC(=N/OC(c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1
InChIInChI=1S/C26H21NO/c1-5-13-22(14-6-1)21-27-28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H/b27-21+
InChIKeyXALKZBRZSFSNIM-SZXQPVLSSA-N
MW363.46 g/mol
LogP6.03
Rot. Bonds6

About (E)-1-phenyl-N-trityloxymethanimine

(E)-1-phenyl-N-trityloxymethanimine (PubChem CID 5382595) has the molecular formula C26H21NO and a molecular weight of 363.46 g/mol. Its IUPAC name is (E)-1-phenyl-N-trityloxymethanimine.

Molecular Properties

Compound Name(E)-1-phenyl-N-trityloxymethanimine
PubChem CID5382595
Molecular FormulaC26H21NO
Molecular Weight363.46 g/mol
Exact Mass363.16
IUPAC Name(E)-1-phenyl-N-trityloxymethanimine
SMILESC(=N/OC(c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1
InChIInChI=1S/C26H21NO/c1-5-13-22(14-6-1)21-27-28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H/b27-21+
InChIKeyXALKZBRZSFSNIM-SZXQPVLSSA-N
XLogP6.03
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.46
LogP ≤ 56.03
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'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

5-[(Z)-trityloxyiminomethyl]-3H-2-benzofuran-1-one
CID 87868292
2-trityloxyiminoethanethioic S-acid
CID 87515774
(E)-1-phenyl-N-[3-(trifluoromethyl)phenoxy]methanimine
CID 11357564
3-(4-fluorophenyl)-N-trityloxypropan-1-imine
CID 163288846
(E)-N-phenoxy-1-[3-(trifluoromethyl)phenyl]methanimine
CID 11242540
(4-fluorophenyl)-[2-(hydroxymethyl)-4-(trityloxyiminomethyl)phenyl]methanone
CID 85327020
N'-trityloxyethanimidamide
CID 5477852
1-(benzylideneamino)-1-phenylethanol
CID 154107002
N'-trityloxyethanimidamide;hydrochloride
CID 54600706
[diphenyl(2-phenylethenoxy)methyl]benzene
CID 54172131
N-[[4-[(benzylideneamino)oxymethyl]phenyl]methoxy]-1-phenylmethanimine
CID 2457580
(NE)-N-benzylidene-4-(trifluoromethyl)benzenesulfonamide
CID 23240617

Frequently Asked Questions

What is the IUPAC name of (E)-1-phenyl-N-trityloxymethanimine?
The IUPAC name of (E)-1-phenyl-N-trityloxymethanimine (CID 5382595) is (E)-1-phenyl-N-trityloxymethanimine.
What is the SMILES notation for (E)-1-phenyl-N-trityloxymethanimine?
The canonical SMILES for (E)-1-phenyl-N-trityloxymethanimine is C(=N/OC(c1ccccc1)(c1ccccc1)c1ccccc1)\c1ccccc1.
What is the InChIKey of (E)-1-phenyl-N-trityloxymethanimine?
The InChIKey is XALKZBRZSFSNIM-SZXQPVLSSA-N. The full InChI is InChI=1S/C26H21NO/c1-5-13-22(14-6-1)21-27-28-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H/b27-21+.
What are the key properties of (E)-1-phenyl-N-trityloxymethanimine?
(E)-1-phenyl-N-trityloxymethanimine has a molecular weight of 363.46 g/mol, XLogP of 6.03, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-phenyl-N-trityloxymethanimine is sourced from PubChem (CID 5382595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).