5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide

C13H11FN2O2 — CID 71591224

IUPAC5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1cc(F)ccc1O
InChIInChI=1S/C13H11FN2O2/c14-9-4-5-12(17)11(7-9)13(18)16-8-10-3-1-2-6-15-10/h1-7,17H,8H2,(H,16,18)
InChIKeyGATDESBWJWQKSB-UHFFFAOYSA-N
MW246.24 g/mol
LogP1.86
Rot. Bonds3

About 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide

5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 71591224) has the molecular formula C13H11FN2O2 and a molecular weight of 246.24 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide
PubChem CID71591224
Molecular FormulaC13H11FN2O2
Molecular Weight246.24 g/mol
Exact Mass246.08
IUPAC Name5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1cc(F)ccc1O
InChIInChI=1S/C13H11FN2O2/c14-9-4-5-12(17)11(7-9)13(18)16-8-10-3-1-2-6-15-10/h1-7,17H,8H2,(H,16,18)
InChIKeyGATDESBWJWQKSB-UHFFFAOYSA-N
XLogP1.86
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.24
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide (CID 71591224) is 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide is O=C(NCc1ccccn1)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is GATDESBWJWQKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2/c14-9-4-5-12(17)11(7-9)13(18)16-8-10-3-1-2-6-15-10/h1-7,17H,8H2,(H,16,18).
What are the key properties of 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide?
5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 246.24 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 71591224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).