N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide

C17H16N4O — CID 71943772

IUPACN-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide
SMILESCc1ccc(-n2nc(C)cc2NC(=O)c2ccncc2)cc1
InChIInChI=1S/C17H16N4O/c1-12-3-5-15(6-4-12)21-16(11-13(2)20-21)19-17(22)14-7-9-18-10-8-14/h3-11H,1-2H3,(H,19,22)
InChIKeyWEMXPGARTGXXMG-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.14
Rot. Bonds3

About N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide

N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide (PubChem CID 71943772) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide
PubChem CID71943772
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC NameN-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide
SMILESCc1ccc(-n2nc(C)cc2NC(=O)c2ccncc2)cc1
InChIInChI=1S/C17H16N4O/c1-12-3-5-15(6-4-12)21-16(11-13(2)20-21)19-17(22)14-7-9-18-10-8-14/h3-11H,1-2H3,(H,19,22)
InChIKeyWEMXPGARTGXXMG-UHFFFAOYSA-N
XLogP3.14
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 2352142
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-4-phenoxybenzamide
CID 3372740
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyrazine-2-carboxamide
CID 43036761
3-methyl-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-4-nitrobenzamide
CID 43018544
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-3-(trifluoromethyl)benzamide
CID 43018526
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-4-imidazol-1-ylbenzamide
CID 172890573
N-[2-(4-fluorophenyl)-5-methylpyrazol-3-yl]-3-methylbenzamide
CID 112805726
3-chloro-4,5-dimethoxy-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 43036788
5-bromo-2-chloro-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]benzamide
CID 43018546
3,5-dimethyl-N-[5-methyl-2-(4-nitrophenyl)pyrazol-3-yl]benzamide
CID 55520402
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-(trifluoromethyl)benzamide
CID 75524900
N-[5-methyl-2-(4-nitrophenyl)pyrazol-3-yl]-4-(trifluoromethyl)benzamide
CID 55508208

Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide?
The IUPAC name of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide (CID 71943772) is N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide is Cc1ccc(-n2nc(C)cc2NC(=O)c2ccncc2)cc1.
What is the InChIKey of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide?
The InChIKey is WEMXPGARTGXXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c1-12-3-5-15(6-4-12)21-16(11-13(2)20-21)19-17(22)14-7-9-18-10-8-14/h3-11H,1-2H3,(H,19,22).
What are the key properties of N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide?
N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]pyridine-4-carboxamide is sourced from PubChem (CID 71943772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).