N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide

C17H13FN4O2 — CID 86788434

IUPACN-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide
SMILESCC(=O)c1ccc(F)cc1NC(=O)c1cc(-n2cccn2)ccn1
InChIInChI=1S/C17H13FN4O2/c1-11(23)14-4-3-12(18)9-15(14)21-17(24)16-10-13(5-7-19-16)22-8-2-6-20-22/h2-10H,1H3,(H,21,24)
InChIKeyFYUVSWHNWXZHPC-UHFFFAOYSA-N
MW324.32 g/mol
LogP2.86
Rot. Bonds4

About N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide

N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide (PubChem CID 86788434) has the molecular formula C17H13FN4O2 and a molecular weight of 324.32 g/mol. Its IUPAC name is N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide
PubChem CID86788434
Molecular FormulaC17H13FN4O2
Molecular Weight324.32 g/mol
Exact Mass324.10
IUPAC NameN-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide
SMILESCC(=O)c1ccc(F)cc1NC(=O)c1cc(-n2cccn2)ccn1
InChIInChI=1S/C17H13FN4O2/c1-11(23)14-4-3-12(18)9-15(14)21-17(24)16-10-13(5-7-19-16)22-8-2-6-20-22/h2-10H,1H3,(H,21,24)
InChIKeyFYUVSWHNWXZHPC-UHFFFAOYSA-N
XLogP2.86
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.32
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methylsulfinylphenyl)-4-pyrazol-1-ylpyridine-2-carboxamide
CID 71994536
N-(2-acetyl-5-fluorophenyl)-2-methylpyrazole-3-carboxamide
CID 75484643
N-(4-methyl-3-oxopyrazin-2-yl)-4-pyrazol-1-ylpyridine-2-carboxamide
CID 71857660
2-chloro-4-fluoro-N-(2-pyrazol-1-yl-3-pyridinyl)benzamide
CID 30884817
4-fluoro-2-[(4-methoxybenzoyl)amino]-N-[(3-pyrazol-1-ylphenyl)methyl]benzamide
CID 86966161
2-prop-1-en-2-yl-4-pyrazol-1-ylpyridine
CID 175922908
N-(2-amino-2-methylpropyl)-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
CID 119626185
N-[2-(methylamino)propyl]-4-pyrazol-1-ylpyridine-2-carboxamide
CID 120827316
N-(3-aminopropyl)-4-pyrazol-1-ylpyridine-2-carboxamide
CID 119405198
N-(3-fluorophenyl)-3-pyrazol-1-ylbenzamide
CID 95968194
N-(4-pyrazol-1-ylphenyl)pyridine-2-carboxamide
CID 35275358
N-(4-cyano-1-propan-2-ylpyrazol-3-yl)-4-pyrazol-1-ylpyridine-2-carboxamide
CID 71853024

Frequently Asked Questions

What is the IUPAC name of N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide?
The IUPAC name of N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide (CID 86788434) is N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide is CC(=O)c1ccc(F)cc1NC(=O)c1cc(-n2cccn2)ccn1.
What is the InChIKey of N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide?
The InChIKey is FYUVSWHNWXZHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN4O2/c1-11(23)14-4-3-12(18)9-15(14)21-17(24)16-10-13(5-7-19-16)22-8-2-6-20-22/h2-10H,1H3,(H,21,24).
What are the key properties of N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide?
N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide has a molecular weight of 324.32 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetyl-5-fluorophenyl)-4-pyrazol-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 86788434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).