(4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone

C19H14FNO3 — CID 134144942

IUPAC(4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone
SMILESCc1ccc(-c2cccc(C(=O)c3ccc(F)c(O)c3)n2)cc1O
InChIInChI=1S/C19H14FNO3/c1-11-5-6-12(9-17(11)22)15-3-2-4-16(21-15)19(24)13-7-8-14(20)18(23)10-13/h2-10,22-23H,1H3
InChIKeyPEFVEBVLOKRRRG-UHFFFAOYSA-N
MW323.32 g/mol
LogP3.84
Rot. Bonds3

About (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone

(4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone (PubChem CID 134144942) has the molecular formula C19H14FNO3 and a molecular weight of 323.32 g/mol. Its IUPAC name is (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone.

Molecular Properties

Compound Name(4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone
PubChem CID134144942
Molecular FormulaC19H14FNO3
Molecular Weight323.32 g/mol
Exact Mass323.10
IUPAC Name(4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone
SMILESCc1ccc(-c2cccc(C(=O)c3ccc(F)c(O)c3)n2)cc1O
InChIInChI=1S/C19H14FNO3/c1-11-5-6-12(9-17(11)22)15-3-2-4-16(21-15)19(24)13-7-8-14(20)18(23)10-13/h2-10,22-23H,1H3
InChIKeyPEFVEBVLOKRRRG-UHFFFAOYSA-N
XLogP3.84
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.32
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone?
The IUPAC name of (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone (CID 134144942) is (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone.
What is the SMILES notation for (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone?
The canonical SMILES for (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone is Cc1ccc(-c2cccc(C(=O)c3ccc(F)c(O)c3)n2)cc1O.
What is the InChIKey of (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone?
The InChIKey is PEFVEBVLOKRRRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO3/c1-11-5-6-12(9-17(11)22)15-3-2-4-16(21-15)19(24)13-7-8-14(20)18(23)10-13/h2-10,22-23H,1H3.
What are the key properties of (4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone?
(4-fluoro-3-hydroxyphenyl)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone has a molecular weight of 323.32 g/mol, XLogP of 3.84, 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)-[6-(3-hydroxy-4-methylphenyl)-2-pyridinyl]methanone is sourced from PubChem (CID 134144942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).