3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol

C18H15NO2 — CID 71462587

IUPAC3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol
SMILESCc1cc(Oc2cccc(O)c2)cc(-c2ccccc2)n1
InChIInChI=1S/C18H15NO2/c1-13-10-17(21-16-9-5-8-15(20)11-16)12-18(19-13)14-6-3-2-4-7-14/h2-12,20H,1H3
InChIKeySJHYRSDSTDNDIP-UHFFFAOYSA-N
MW277.32 g/mol
LogP4.55
Rot. Bonds3

About 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol

3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol (PubChem CID 71462587) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol.

Molecular Properties

Compound Name3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol
PubChem CID71462587
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol
SMILESCc1cc(Oc2cccc(O)c2)cc(-c2ccccc2)n1
InChIInChI=1S/C18H15NO2/c1-13-10-17(21-16-9-5-8-15(20)11-16)12-18(19-13)14-6-3-2-4-7-14/h2-12,20H,1H3
InChIKeySJHYRSDSTDNDIP-UHFFFAOYSA-N
XLogP4.55
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol?
The IUPAC name of 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol (CID 71462587) is 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol.
What is the SMILES notation for 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol?
The canonical SMILES for 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol is Cc1cc(Oc2cccc(O)c2)cc(-c2ccccc2)n1.
What is the InChIKey of 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol?
The InChIKey is SJHYRSDSTDNDIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c1-13-10-17(21-16-9-5-8-15(20)11-16)12-18(19-13)14-6-3-2-4-7-14/h2-12,20H,1H3.
What are the key properties of 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol?
3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol has a molecular weight of 277.32 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methyl-6-phenyl-4-pyridinyl)oxy]phenol is sourced from PubChem (CID 71462587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).