4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide

C10H8FN3O2 — CID 103829854

IUPAC4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide
SMILESO=C(Nc1ccn[nH]1)c1ccc(F)cc1O
InChIInChI=1S/C10H8FN3O2/c11-6-1-2-7(8(15)5-6)10(16)13-9-3-4-12-14-9/h1-5,15H,(H2,12,13,14,16)
InChIKeyJPGBATBMDNAFGL-UHFFFAOYSA-N
MW221.19 g/mol
LogP1.51
Rot. Bonds2

About 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide

4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide (PubChem CID 103829854) has the molecular formula C10H8FN3O2 and a molecular weight of 221.19 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide
PubChem CID103829854
Molecular FormulaC10H8FN3O2
Molecular Weight221.19 g/mol
Exact Mass221.06
IUPAC Name4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide
SMILESO=C(Nc1ccn[nH]1)c1ccc(F)cc1O
InChIInChI=1S/C10H8FN3O2/c11-6-1-2-7(8(15)5-6)10(16)13-9-3-4-12-14-9/h1-5,15H,(H2,12,13,14,16)
InChIKeyJPGBATBMDNAFGL-UHFFFAOYSA-N
XLogP1.51
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.19
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-difluoro-6-hydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 47466440
4-fluoro-2-hydroxy-N-(1H-1,2,4-triazol-5-yl)benzamide
CID 103829726
2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide
CID 103710669
3,4-dihydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 103956763
N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide
CID 103887364
4-fluoro-2-hydroxy-N-(5-methyl-1H-1,2,4-triazol-3-yl)benzamide
CID 103830032
4-fluoro-2-hydroxy-N-(2,4,6-trichlorophenyl)benzamide
CID 107015128
N-(4-carbamothioylphenyl)-4-fluoro-2-hydroxybenzamide
CID 107014847
3-bromo-5-fluoro-N-(1H-pyrazol-5-yl)benzamide
CID 61393796
5-amino-2-bromo-4-fluoro-N-(1H-pyrazol-5-yl)benzamide
CID 62815610
N-(2,6-difluorophenyl)-4-fluoro-2-hydroxybenzamide
CID 103888059
[(2S)-4-[4-fluoro-2-(1H-pyrazol-5-ylcarbamoyl)phenyl]-3-oxobutan-2-yl] carbamate
CID 175527707

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide (CID 103829854) is 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide is O=C(Nc1ccn[nH]1)c1ccc(F)cc1O.
What is the InChIKey of 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide?
The InChIKey is JPGBATBMDNAFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O2/c11-6-1-2-7(8(15)5-6)10(16)13-9-3-4-12-14-9/h1-5,15H,(H2,12,13,14,16).
What are the key properties of 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide?
4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide has a molecular weight of 221.19 g/mol, XLogP of 1.51, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 103829854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).