(4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone

C18H11F2NO3 — CID 134132086

IUPAC(4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone
SMILESO=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(F)c2)cn1
InChIInChI=1S/C18H11F2NO3/c19-13-4-1-11(8-17(13)23)18(24)15-5-2-12(9-21-15)10-3-6-16(22)14(20)7-10/h1-9,22-23H
InChIKeyLFQXAVZIVVNJHJ-UHFFFAOYSA-N
MW327.29 g/mol
LogP3.67
Rot. Bonds3

About (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone

(4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone (PubChem CID 134132086) has the molecular formula C18H11F2NO3 and a molecular weight of 327.29 g/mol. Its IUPAC name is (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone.

Molecular Properties

Compound Name(4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone
PubChem CID134132086
Molecular FormulaC18H11F2NO3
Molecular Weight327.29 g/mol
Exact Mass327.07
IUPAC Name(4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone
SMILESO=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(F)c2)cn1
InChIInChI=1S/C18H11F2NO3/c19-13-4-1-11(8-17(13)23)18(24)15-5-2-12(9-21-15)10-3-6-16(22)14(20)7-10/h1-9,22-23H
InChIKeyLFQXAVZIVVNJHJ-UHFFFAOYSA-N
XLogP3.67
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.29
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Phenopicolinic acid
CID 3043792
3-[5-(3-Hydroxyphenyl)pyridin-2-yl]phenol
CID 25093398
(4-Fluoranyl-3-Oxidanyl-Phenyl)-[6-(2-Fluoranyl-3-Oxidanyl-Phenyl)pyridin-2-Yl]methanone
CID 122707109
(4-Fluoranyl-3-oxidanyl-phenyl)-quinolin-2-yl-methanone
CID 134158358
[2,3-Bis(Oxidanyl)phenyl]-[6-(2-Fluoranyl-3-Oxidanyl-Phenyl)pyridin-2-Yl]methanone
CID 135567095
[6-(3,4-Dihydroxyphenyl)pyridin-2-Yl](4-Fluoro-3-Hydroxyphenyl)methanone
CID 135567153
(4-Fluoranyl-3-Oxidanyl-Phenyl)-[6-(3-Methyl-4-Oxidanyl-Phenyl)pyridin-2-Yl]methanone
CID 135567209
[4-Fluoranyl-2,3-Bis(Oxidanyl)phenyl]-[6-(2-Fluoranyl-3-Oxidanyl-Phenyl)pyridin-2-Yl]methanone
CID 135567210
CA standard inhibitor, 2
CID 19564789
4-[6-(3-Hydroxyphenyl)pyrazin-2-Yl]benzoic Acid
CID 86290236
(E)-1-(3-hydroxyphenyl)-3-pyridin-3-ylprop-2-en-1-one
CID 16304855
5-Hydroxy-2-pyridin-4-ylmethylene-3,4-dihydro-2H-naphthalen-1-one
CID 15072948

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone?
The IUPAC name of (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone (CID 134132086) is (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone.
What is the SMILES notation for (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone?
The canonical SMILES for (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone is O=C(c1ccc(F)c(O)c1)c1ccc(-c2ccc(O)c(F)c2)cn1.
What is the InChIKey of (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone?
The InChIKey is LFQXAVZIVVNJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11F2NO3/c19-13-4-1-11(8-17(13)23)18(24)15-5-2-12(9-21-15)10-3-6-16(22)14(20)7-10/h1-9,22-23H.
What are the key properties of (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone?
(4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone has a molecular weight of 327.29 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-3-hydroxyphenyl)-[5-(3-fluoro-4-hydroxyphenyl)-2-pyridinyl]methanone is sourced from PubChem (CID 134132086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).