(4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone

C12H8FNO2 — CID 118814313

IUPAC(4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone
SMILESO=C(c1ccc(F)c(O)c1)c1ccccn1
InChIInChI=1S/C12H8FNO2/c13-9-5-4-8(7-11(9)15)12(16)10-3-1-2-6-14-10/h1-7,15H
InChIKeyLNRJQPSMOUKTRE-UHFFFAOYSA-N
MW217.20 g/mol
LogP2.16
Rot. Bonds2

About (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone

(4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone (PubChem CID 118814313) has the molecular formula C12H8FNO2 and a molecular weight of 217.20 g/mol. Its IUPAC name is (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone
PubChem CID118814313
Molecular FormulaC12H8FNO2
Molecular Weight217.20 g/mol
Exact Mass217.05
IUPAC Name(4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone
SMILESO=C(c1ccc(F)c(O)c1)c1ccccn1
InChIInChI=1S/C12H8FNO2/c13-9-5-4-8(7-11(9)15)12(16)10-3-1-2-6-14-10/h1-7,15H
InChIKeyLNRJQPSMOUKTRE-UHFFFAOYSA-N
XLogP2.16
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.20
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone?
The IUPAC name of (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone (CID 118814313) is (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone.
What is the SMILES notation for (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone?
The canonical SMILES for (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone is O=C(c1ccc(F)c(O)c1)c1ccccn1.
What is the InChIKey of (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone?
The InChIKey is LNRJQPSMOUKTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8FNO2/c13-9-5-4-8(7-11(9)15)12(16)10-3-1-2-6-14-10/h1-7,15H.
What are the key properties of (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone?
(4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone has a molecular weight of 217.20 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-3-hydroxyphenyl)-pyridin-2-ylmethanone is sourced from PubChem (CID 118814313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).