N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C16H12F2N4O2 — CID 71917921

IUPACN-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cc(-c3cccc(F)c3F)[nH]n2)c(=O)[nH]1
InChIInChI=1S/C16H12F2N4O2/c1-8-5-6-10(15(23)19-8)16(24)20-13-7-12(21-22-13)9-3-2-4-11(17)14(9)18/h2-7H,1H3,(H,19,23)(H2,20,21,22,24)
InChIKeyAVSQARLOZGBDCF-UHFFFAOYSA-N
MW330.29 g/mol
LogP2.60
Rot. Bonds3

About N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 71917921) has the molecular formula C16H12F2N4O2 and a molecular weight of 330.29 g/mol. Its IUPAC name is N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID71917921
Molecular FormulaC16H12F2N4O2
Molecular Weight330.29 g/mol
Exact Mass330.09
IUPAC NameN-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cc(-c3cccc(F)c3F)[nH]n2)c(=O)[nH]1
InChIInChI=1S/C16H12F2N4O2/c1-8-5-6-10(15(23)19-8)16(24)20-13-7-12(21-22-13)9-3-2-4-11(17)14(9)18/h2-7H,1H3,(H,19,23)(H2,20,21,22,24)
InChIKeyAVSQARLOZGBDCF-UHFFFAOYSA-N
XLogP2.60
TPSA90.64 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.29
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-2-ethylsulfonylacetamide
CID 75381080
6-amino-N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
CID 166319443
1-cyclopropyl-N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-2-oxo-3H-benzimidazole-5-carboxamide
CID 154851203
N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-3-[[(2-methylpyrimidin-4-yl)amino]methyl]benzamide
CID 154838311
N-(4-bromo-2,6-difluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 115666671
N-(3-bromo-4-fluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 71993657
N-(4-methoxy-2-pyridinyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 75434501
N-(4-bromo-3-fluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 113241584
1-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-3-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]urea
CID 154873617
N-(5-ethyl-1H-pyrazol-3-yl)-2-fluorobenzamide
CID 47423207
4-fluoro-2-iodo-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]benzamide
CID 56552510
6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 71917921) is N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)Nc2cc(-c3cccc(F)c3F)[nH]n2)c(=O)[nH]1.
What is the InChIKey of N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is AVSQARLOZGBDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2N4O2/c1-8-5-6-10(15(23)19-8)16(24)20-13-7-12(21-22-13)9-3-2-4-11(17)14(9)18/h2-7H,1H3,(H,19,23)(H2,20,21,22,24).
What are the key properties of N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 330.29 g/mol, XLogP of 2.60, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,3-difluorophenyl)-1H-pyrazol-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 71917921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).