2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile

C15H11N3 — CID 102593180

IUPAC2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile
SMILESCc1ccc(-c2cc3cc(C#N)ccn3n2)cc1
InChIInChI=1S/C15H11N3/c1-11-2-4-13(5-3-11)15-9-14-8-12(10-16)6-7-18(14)17-15/h2-9H,1H3
InChIKeyYBGZALHDWJEUDK-UHFFFAOYSA-N
MW233.27 g/mol
LogP3.18
Rot. Bonds1

About 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile

2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile (PubChem CID 102593180) has the molecular formula C15H11N3 and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile.

Molecular Properties

Compound Name2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile
PubChem CID102593180
Molecular FormulaC15H11N3
Molecular Weight233.27 g/mol
Exact Mass233.10
IUPAC Name2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile
SMILESCc1ccc(-c2cc3cc(C#N)ccn3n2)cc1
InChIInChI=1S/C15H11N3/c1-11-2-4-13(5-3-11)15-9-14-8-12(10-16)6-7-18(14)17-15/h2-9H,1H3
InChIKeyYBGZALHDWJEUDK-UHFFFAOYSA-N
XLogP3.18
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-amino-3-(4-methylphenyl)pyrazol-1-yl]benzonitrile
CID 43542996
2-methyl-6-(4-methylphenyl)-3-oxopyridazine-4-carbonitrile
CID 82443798
3-(3,5-dimethylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-7-carbonitrile
CID 105393093
2-(4-methylphenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 57022324
4-(1-methyl-5-phenylpyrazol-3-yl)benzonitrile
CID 143438272
2-(4-tert-butylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbonitrile
CID 82567186
3-propan-2-ylpyrazolo[1,5-a]pyridine-5-carbonitrile
CID 169163184
1,5-dimethyl-3-(4-methylphenyl)pyrazole
CID 10679126
4-[4-[(4-methylphenoxy)methoxy]phenyl]benzonitrile
CID 129203224
4-[1-(4-methylphenyl)triazol-4-yl]benzonitrile
CID 134864603
2-methyl-1-phenylindolizine-3,7-dicarbonitrile
CID 11161205
2-(4-methylphenyl)-3H-benzimidazole-5-carbonitrile
CID 10489821

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile?
The IUPAC name of 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile (CID 102593180) is 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile.
What is the SMILES notation for 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile?
The canonical SMILES for 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile is Cc1ccc(-c2cc3cc(C#N)ccn3n2)cc1.
What is the InChIKey of 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile?
The InChIKey is YBGZALHDWJEUDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3/c1-11-2-4-13(5-3-11)15-9-14-8-12(10-16)6-7-18(14)17-15/h2-9H,1H3.
What are the key properties of 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile?
2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile has a molecular weight of 233.27 g/mol, XLogP of 3.18, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)pyrazolo[1,5-a]pyridine-5-carbonitrile is sourced from PubChem (CID 102593180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).