1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide

C16H11FN6O — CID 56784157

IUPAC1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide
SMILESO=C(Nc1ccnc2ccnn12)c1ccn(-c2ccccc2F)n1
InChIInChI=1S/C16H11FN6O/c17-11-3-1-2-4-13(11)22-10-7-12(21-22)16(24)20-15-5-8-18-14-6-9-19-23(14)15/h1-10H,(H,20,24)
InChIKeyAXLXIXPIAPFSHE-UHFFFAOYSA-N
MW322.30 g/mol
LogP2.31
Rot. Bonds3

About 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide

1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide (PubChem CID 56784157) has the molecular formula C16H11FN6O and a molecular weight of 322.30 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide
PubChem CID56784157
Molecular FormulaC16H11FN6O
Molecular Weight322.30 g/mol
Exact Mass322.10
IUPAC Name1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide
SMILESO=C(Nc1ccnc2ccnn12)c1ccn(-c2ccccc2F)n1
InChIInChI=1S/C16H11FN6O/c17-11-3-1-2-4-13(11)22-10-7-12(21-22)16(24)20-15-5-8-18-14-6-9-19-23(14)15/h1-10H,(H,20,24)
InChIKeyAXLXIXPIAPFSHE-UHFFFAOYSA-N
XLogP2.31
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.30
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N~4~,N~4~,1-trimethyl-N~5~-[(4R)-2-phenylimidazo[1,2-a]pyridin-7-yl]-1H-pyrazole-4,5-dicarboxamide
CID 51033482
4-(3-fluoroazetidine-1-carbonyl)-1-methyl-N-(2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
CID 57377630
4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid (6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-amide
CID 57377741
N-(3-(1H-imidazol-1-yl)propyl)-5,7-diphenylpyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 3113005
6-methyl-N-(1-phenylpyrazol-3-yl)-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
CID 53330913
N-(2-(dimethylamino)-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-4-(3-fluoroazetidine-1-carbonyl)-1-methyl-1H-pyrazole-5-carboxamide
CID 57377850
4-(3-fluoroazetidine-1-carbonyl)-1-methyl-N-(2-(pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-pyrazole-5-carboxamide
CID 57377960
4-(3-fluoro-azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid (2-isopropyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-amide
CID 57378066
4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid {2-[(2-fluoro-ethyl)-methyl-amino]-[1,2,4]triazolo[1,5-a]pyridin-7-yl}-amide
CID 57378391
N-[2-[2-fluoroethyl(methyl)amino]-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-methyl-4-(morpholine-4-carbonyl)pyrazole-5-carboxamide
CID 57378392
5-(2-(3-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-7-ylcarbamoyl)-1-methyl-1H-pyrazole-4-carboxylic acid
CID 67775229
4-(azetidine-1-carbonyl)-2-methyl-2H-pyrazole-3-carboxylic acid [2-(2-fluoro-pyridin-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-amide
CID 67775398

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide (CID 56784157) is 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide is O=C(Nc1ccnc2ccnn12)c1ccn(-c2ccccc2F)n1.
What is the InChIKey of 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide?
The InChIKey is AXLXIXPIAPFSHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN6O/c17-11-3-1-2-4-13(11)22-10-7-12(21-22)16(24)20-15-5-8-18-14-6-9-19-23(14)15/h1-10H,(H,20,24).
What are the key properties of 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide?
1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide has a molecular weight of 322.30 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-pyrazolo[1,5-a]pyrimidin-7-ylpyrazole-3-carboxamide is sourced from PubChem (CID 56784157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).