2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol

C16H11FN2O2 — CID 166633150

IUPAC2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol
SMILESOc1cccc(-c2cccc(Oc3cccnc3)n2)c1F
InChIInChI=1S/C16H11FN2O2/c17-16-12(5-1-7-14(16)20)13-6-2-8-15(19-13)21-11-4-3-9-18-10-11/h1-10,20H
InChIKeyUSICTMNLGHNAHD-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.78
Rot. Bonds3

About 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol

2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol (PubChem CID 166633150) has the molecular formula C16H11FN2O2 and a molecular weight of 282.27 g/mol. Its IUPAC name is 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol.

Molecular Properties

Compound Name2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol
PubChem CID166633150
Molecular FormulaC16H11FN2O2
Molecular Weight282.27 g/mol
Exact Mass282.08
IUPAC Name2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol
SMILESOc1cccc(-c2cccc(Oc3cccnc3)n2)c1F
InChIInChI=1S/C16H11FN2O2/c17-16-12(5-1-7-14(16)20)13-6-2-8-15(19-13)21-11-4-3-9-18-10-11/h1-10,20H
InChIKeyUSICTMNLGHNAHD-UHFFFAOYSA-N
XLogP3.78
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol?
The IUPAC name of 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol (CID 166633150) is 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol.
What is the SMILES notation for 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol?
The canonical SMILES for 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol is Oc1cccc(-c2cccc(Oc3cccnc3)n2)c1F.
What is the InChIKey of 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol?
The InChIKey is USICTMNLGHNAHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O2/c17-16-12(5-1-7-14(16)20)13-6-2-8-15(19-13)21-11-4-3-9-18-10-11/h1-10,20H.
What are the key properties of 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol?
2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol has a molecular weight of 282.27 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-(6-pyridin-3-yloxy-2-pyridinyl)phenol is sourced from PubChem (CID 166633150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).