9-(2-anilinophenyl)xanthen-9-ol

C25H19NO2 — CID 135194804

IUPAC9-(2-anilinophenyl)xanthen-9-ol
SMILESOC1(c2ccccc2Nc2ccccc2)c2ccccc2Oc2ccccc21
InChIInChI=1S/C25H19NO2/c27-25(19-12-4-7-15-22(19)26-18-10-2-1-3-11-18)20-13-5-8-16-23(20)28-24-17-9-6-14-21(24)25/h1-17,26-27H
InChIKeyYJQXRIPUODIRML-UHFFFAOYSA-N
MW365.43 g/mol
LogP5.82
Rot. Bonds3

About 9-(2-anilinophenyl)xanthen-9-ol

9-(2-anilinophenyl)xanthen-9-ol (PubChem CID 135194804) has the molecular formula C25H19NO2 and a molecular weight of 365.43 g/mol. Its IUPAC name is 9-(2-anilinophenyl)xanthen-9-ol.

Molecular Properties

Compound Name9-(2-anilinophenyl)xanthen-9-ol
PubChem CID135194804
Molecular FormulaC25H19NO2
Molecular Weight365.43 g/mol
Exact Mass365.14
IUPAC Name9-(2-anilinophenyl)xanthen-9-ol
SMILESOC1(c2ccccc2Nc2ccccc2)c2ccccc2Oc2ccccc21
InChIInChI=1S/C25H19NO2/c27-25(19-12-4-7-15-22(19)26-18-10-2-1-3-11-18)20-13-5-8-16-23(20)28-24-17-9-6-14-21(24)25/h1-17,26-27H
InChIKeyYJQXRIPUODIRML-UHFFFAOYSA-N
XLogP5.82
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.43
LogP ≤ 55.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(2-anilinophenyl)xanthen-9-ol?
The IUPAC name of 9-(2-anilinophenyl)xanthen-9-ol (CID 135194804) is 9-(2-anilinophenyl)xanthen-9-ol.
What is the SMILES notation for 9-(2-anilinophenyl)xanthen-9-ol?
The canonical SMILES for 9-(2-anilinophenyl)xanthen-9-ol is OC1(c2ccccc2Nc2ccccc2)c2ccccc2Oc2ccccc21.
What is the InChIKey of 9-(2-anilinophenyl)xanthen-9-ol?
The InChIKey is YJQXRIPUODIRML-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19NO2/c27-25(19-12-4-7-15-22(19)26-18-10-2-1-3-11-18)20-13-5-8-16-23(20)28-24-17-9-6-14-21(24)25/h1-17,26-27H.
What are the key properties of 9-(2-anilinophenyl)xanthen-9-ol?
9-(2-anilinophenyl)xanthen-9-ol has a molecular weight of 365.43 g/mol, XLogP of 5.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-anilinophenyl)xanthen-9-ol is sourced from PubChem (CID 135194804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).