N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide

C12H11N5O — CID 110472162

IUPACN-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2c(C#N)cnn2C)n1
InChIInChI=1S/C12H11N5O/c1-8-4-3-5-10(15-8)12(18)16-11-9(6-13)7-14-17(11)2/h3-5,7H,1-2H3,(H,16,18)
InChIKeyDJXJNGTZLKRLIY-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.25
Rot. Bonds2

About N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide

N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide (PubChem CID 110472162) has the molecular formula C12H11N5O and a molecular weight of 241.25 g/mol. Its IUPAC name is N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide
PubChem CID110472162
Molecular FormulaC12H11N5O
Molecular Weight241.25 g/mol
Exact Mass241.10
IUPAC NameN-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2c(C#N)cnn2C)n1
InChIInChI=1S/C12H11N5O/c1-8-4-3-5-10(15-8)12(18)16-11-9(6-13)7-14-17(11)2/h3-5,7H,1-2H3,(H,16,18)
InChIKeyDJXJNGTZLKRLIY-UHFFFAOYSA-N
XLogP1.25
TPSA83.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(4-cyano-1-methylpyrazol-5-yl)-3-fluorobenzamide
CID 81453960
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CID 112723593
N-(4-cyano-1-methylpyrazol-5-yl)-2-methylfuran-3-carboxamide
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4-cyano-N-(4-cyano-1-methylpyrazol-5-yl)benzamide
CID 112723104
N-(4-cyano-1-methylpyrazol-5-yl)-3,4-dimethylbenzamide
CID 112723715
N-(4-cyano-1-methylpyrazol-5-yl)-4-hydroxy-2-methylbenzamide
CID 107671438
N-(4-cyano-1-methylpyrazol-5-yl)-5-methyl-1,2-oxazole-4-carboxamide
CID 113220547
N-(4-cyano-1-methylpyrazol-5-yl)-4-[(4,6-dimethylpyrimidin-2-yl)amino]benzamide
CID 108737103
7-chloro-N-(4-cyano-1-methylpyrazol-5-yl)-1H-indole-2-carboxamide
CID 108737124
N-(4-cyano-1-methylpyrazol-5-yl)-3-hydroxy-4-methylbenzamide
CID 79503285
2,2,2-trichloro-N-(4-cyano-1-methylpyrazol-5-yl)acetamide
CID 108737045
N-(4-cyano-1-methylpyrazol-5-yl)-2-methyl-4-nitrobenzamide
CID 79497143

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide?
The IUPAC name of N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide (CID 110472162) is N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2c(C#N)cnn2C)n1.
What is the InChIKey of N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide?
The InChIKey is DJXJNGTZLKRLIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O/c1-8-4-3-5-10(15-8)12(18)16-11-9(6-13)7-14-17(11)2/h3-5,7H,1-2H3,(H,16,18).
What are the key properties of N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide?
N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide has a molecular weight of 241.25 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-1-methylpyrazol-5-yl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 110472162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).