N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide

C12H9FN2O3 — CID 86817229

IUPACN-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide
SMILESO=C(Nc1cccc(O)c1F)c1ncccc1O
InChIInChI=1S/C12H9FN2O3/c13-10-7(3-1-4-8(10)16)15-12(18)11-9(17)5-2-6-14-11/h1-6,16-17H,(H,15,18)
InChIKeyKIXGIZUNLNHMAQ-UHFFFAOYSA-N
MW248.21 g/mol
LogP1.88
Rot. Bonds2

About N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide

N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide (PubChem CID 86817229) has the molecular formula C12H9FN2O3 and a molecular weight of 248.21 g/mol. Its IUPAC name is N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide
PubChem CID86817229
Molecular FormulaC12H9FN2O3
Molecular Weight248.21 g/mol
Exact Mass248.06
IUPAC NameN-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide
SMILESO=C(Nc1cccc(O)c1F)c1ncccc1O
InChIInChI=1S/C12H9FN2O3/c13-10-7(3-1-4-8(10)16)15-12(18)11-9(17)5-2-6-14-11/h1-6,16-17H,(H,15,18)
InChIKeyKIXGIZUNLNHMAQ-UHFFFAOYSA-N
XLogP1.88
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.21
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide?
The IUPAC name of N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide (CID 86817229) is N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide.
What is the SMILES notation for N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide?
The canonical SMILES for N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide is O=C(Nc1cccc(O)c1F)c1ncccc1O.
What is the InChIKey of N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide?
The InChIKey is KIXGIZUNLNHMAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FN2O3/c13-10-7(3-1-4-8(10)16)15-12(18)11-9(17)5-2-6-14-11/h1-6,16-17H,(H,15,18).
What are the key properties of N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide?
N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide has a molecular weight of 248.21 g/mol, XLogP of 1.88, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-3-hydroxyphenyl)-3-hydroxypyridine-2-carboxamide is sourced from PubChem (CID 86817229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).