3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol

C23H18N2O — CID 68841722

IUPAC3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol
SMILESOc1cc(Nc2cccnc2)cc(-c2cccc(-c3ccccc3)c2)c1
InChIInChI=1S/C23H18N2O/c26-23-14-20(13-22(15-23)25-21-10-5-11-24-16-21)19-9-4-8-18(12-19)17-6-2-1-3-7-17/h1-16,25-26H
InChIKeyOSUIREGOHDQSLS-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.86
Rot. Bonds4

About 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol

3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol (PubChem CID 68841722) has the molecular formula C23H18N2O and a molecular weight of 338.41 g/mol. Its IUPAC name is 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol.

Molecular Properties

Compound Name3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol
PubChem CID68841722
Molecular FormulaC23H18N2O
Molecular Weight338.41 g/mol
Exact Mass338.14
IUPAC Name3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol
SMILESOc1cc(Nc2cccnc2)cc(-c2cccc(-c3ccccc3)c2)c1
InChIInChI=1S/C23H18N2O/c26-23-14-20(13-22(15-23)25-21-10-5-11-24-16-21)19-9-4-8-18(12-19)17-6-2-1-3-7-17/h1-16,25-26H
InChIKeyOSUIREGOHDQSLS-UHFFFAOYSA-N
XLogP5.86
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
The IUPAC name of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol (CID 68841722) is 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol.
What is the SMILES notation for 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
The canonical SMILES for 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol is Oc1cc(Nc2cccnc2)cc(-c2cccc(-c3ccccc3)c2)c1.
What is the InChIKey of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
The InChIKey is OSUIREGOHDQSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c26-23-14-20(13-22(15-23)25-21-10-5-11-24-16-21)19-9-4-8-18(12-19)17-6-2-1-3-7-17/h1-16,25-26H.
What are the key properties of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol has a molecular weight of 338.41 g/mol, XLogP of 5.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol is sourced from PubChem (CID 68841722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).