(4-phenoxyphenyl)-diphenylazanium

C24H20NO+ — CID 163615593

IUPAC(4-phenoxyphenyl)-diphenylazanium
SMILESc1ccc(Oc2ccc([NH+](c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C24H19NO/c1-4-10-20(11-5-1)25(21-12-6-2-7-13-21)22-16-18-24(19-17-22)26-23-14-8-3-9-15-23/h1-19H/p+1
InChIKeyHJSMJTSHWXEJAO-UHFFFAOYSA-O
MW338.43 g/mol
LogP5.66
Rot. Bonds5

About (4-phenoxyphenyl)-diphenylazanium

(4-phenoxyphenyl)-diphenylazanium (PubChem CID 163615593) has the molecular formula C24H20NO+ and a molecular weight of 338.43 g/mol. Its IUPAC name is (4-phenoxyphenyl)-diphenylazanium.

Molecular Properties

Compound Name(4-phenoxyphenyl)-diphenylazanium
PubChem CID163615593
Molecular FormulaC24H20NO+
Molecular Weight338.43 g/mol
Exact Mass338.15
IUPAC Name(4-phenoxyphenyl)-diphenylazanium
SMILESc1ccc(Oc2ccc([NH+](c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/C24H19NO/c1-4-10-20(11-5-1)25(21-12-6-2-7-13-21)22-16-18-24(19-17-22)26-23-14-8-3-9-15-23/h1-19H/p+1
InChIKeyHJSMJTSHWXEJAO-UHFFFAOYSA-O
XLogP5.66
TPSA13.67 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.43
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

potassium phenoxybenzene
CID 19858586
iron;phenoxybenzene
CID 174434720
CID 159259752
CID 159259752
1,3,5-tris[4-(4-phenoxyphenoxy)phenoxy]benzene
CID 167430627
potassium;hydride;phenoxybenzene
CID 173391576
oxophosphanium;phenoxybenzene
CID 161329594
N-[4-(4-phenoxyphenyl)phenoxy]benzeneamine oxide
CID 163966965
(4-phenoxycarbonylphenyl)-diphenylazanium
CID 163826760
hydroxy(oxo)phosphanium;phenoxybenzene
CID 162014005
4-phenoxyaniline
CID 158390066
boric acid;phenoxybenzene
CID 66799508
1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene
CID 13382331

Frequently Asked Questions

What is the IUPAC name of (4-phenoxyphenyl)-diphenylazanium?
The IUPAC name of (4-phenoxyphenyl)-diphenylazanium (CID 163615593) is (4-phenoxyphenyl)-diphenylazanium.
What is the SMILES notation for (4-phenoxyphenyl)-diphenylazanium?
The canonical SMILES for (4-phenoxyphenyl)-diphenylazanium is c1ccc(Oc2ccc([NH+](c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of (4-phenoxyphenyl)-diphenylazanium?
The InChIKey is HJSMJTSHWXEJAO-UHFFFAOYSA-O. The full InChI is InChI=1S/C24H19NO/c1-4-10-20(11-5-1)25(21-12-6-2-7-13-21)22-16-18-24(19-17-22)26-23-14-8-3-9-15-23/h1-19H/p+1.
What are the key properties of (4-phenoxyphenyl)-diphenylazanium?
(4-phenoxyphenyl)-diphenylazanium has a molecular weight of 338.43 g/mol, XLogP of 5.66, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenoxyphenyl)-diphenylazanium is sourced from PubChem (CID 163615593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).