[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone

C18H10ClF2NO2 — CID 134147999

IUPAC[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
SMILESO=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(F)c(Cl)c2)n1
InChIInChI=1S/C18H10ClF2NO2/c19-12-8-10(4-6-13(12)20)15-2-1-3-16(22-15)18(24)11-5-7-14(21)17(23)9-11/h1-9,23H
InChIKeyOSEYMSKBBXVHMZ-UHFFFAOYSA-N
MW345.73 g/mol
LogP4.62
Rot. Bonds3

About [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone

[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone (PubChem CID 134147999) has the molecular formula C18H10ClF2NO2 and a molecular weight of 345.73 g/mol. Its IUPAC name is [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone.

Molecular Properties

Compound Name[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
PubChem CID134147999
Molecular FormulaC18H10ClF2NO2
Molecular Weight345.73 g/mol
Exact Mass345.04
IUPAC Name[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone
SMILESO=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(F)c(Cl)c2)n1
InChIInChI=1S/C18H10ClF2NO2/c19-12-8-10(4-6-13(12)20)15-2-1-3-16(22-15)18(24)11-5-7-14(21)17(23)9-11/h1-9,23H
InChIKeyOSEYMSKBBXVHMZ-UHFFFAOYSA-N
XLogP4.62
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.73
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
The IUPAC name of [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone (CID 134147999) is [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone.
What is the SMILES notation for [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
The canonical SMILES for [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone is O=C(c1ccc(F)c(O)c1)c1cccc(-c2ccc(F)c(Cl)c2)n1.
What is the InChIKey of [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
The InChIKey is OSEYMSKBBXVHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10ClF2NO2/c19-12-8-10(4-6-13(12)20)15-2-1-3-16(22-15)18(24)11-5-7-14(21)17(23)9-11/h1-9,23H.
What are the key properties of [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone?
[6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone has a molecular weight of 345.73 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-chloro-4-fluorophenyl)-2-pyridinyl]-(4-fluoro-3-hydroxyphenyl)methanone is sourced from PubChem (CID 134147999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).