4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol

C18H15NO2 — CID 23275622

IUPAC4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol
SMILESOc1ccc(C(c2ccncc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C18H15NO2/c20-16-5-1-13(2-6-16)18(15-9-11-19-12-10-15)14-3-7-17(21)8-4-14/h1-12,18,20-21H
InChIKeyHRQXTHWSVIKOLP-UHFFFAOYSA-N
MW277.32 g/mol
LogP3.67
Rot. Bonds3

About 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol

4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol (PubChem CID 23275622) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol.

Molecular Properties

Compound Name4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol
PubChem CID23275622
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol
SMILESOc1ccc(C(c2ccncc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C18H15NO2/c20-16-5-1-13(2-6-16)18(15-9-11-19-12-10-15)14-3-7-17(21)8-4-14/h1-12,18,20-21H
InChIKeyHRQXTHWSVIKOLP-UHFFFAOYSA-N
XLogP3.67
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol?
The IUPAC name of 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol (CID 23275622) is 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol.
What is the SMILES notation for 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol?
The canonical SMILES for 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol is Oc1ccc(C(c2ccncc2)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol?
The InChIKey is HRQXTHWSVIKOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c20-16-5-1-13(2-6-16)18(15-9-11-19-12-10-15)14-3-7-17(21)8-4-14/h1-12,18,20-21H.
What are the key properties of 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol?
4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol has a molecular weight of 277.32 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-hydroxyphenyl)-pyridin-4-ylmethyl]phenol is sourced from PubChem (CID 23275622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).