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

C14H10N4 — CID 115040096

IUPAC1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile
SMILESCc1ccc(-n2ncc3cc(C#N)cnc32)cc1
InChIInChI=1S/C14H10N4/c1-10-2-4-13(5-3-10)18-14-12(9-17-18)6-11(7-15)8-16-14/h2-6,8-9H,1H3
InChIKeyNWAWUWYXBYHIHQ-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.60
Rot. Bonds1

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

1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile (PubChem CID 115040096) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Name1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile
PubChem CID115040096
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile
SMILESCc1ccc(-n2ncc3cc(C#N)cnc32)cc1
InChIInChI=1S/C14H10N4/c1-10-2-4-13(5-3-10)18-14-12(9-17-18)6-11(7-15)8-16-14/h2-6,8-9H,1H3
InChIKeyNWAWUWYXBYHIHQ-UHFFFAOYSA-N
XLogP2.60
TPSA54.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 115040094
[1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methanamine
CID 115042606
1-[5-methyl-4-(oxan-4-ylamino)-2-pyridinyl]pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 171406471
6-(5-cyanopyrazolo[5,4-b]pyridin-1-yl)-4-(methylamino)pyridine-3-carboxamide
CID 171407015
6-[1-(4-methylphenyl)pyrazol-3-yl]pyridine-3-carbonitrile
CID 70253684
1-[4-(cyclopropylamino)-5-propan-2-yl-2-pyridinyl]pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 138727745
1-[4-[[(1R)-1-cyanoethyl]amino]-5-(1,2-oxazol-5-yl)-2-pyridinyl]pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 171406841
4-chloro-1-(4-methylphenyl)pyrazolo[5,4-d]pyrimidine
CID 11207298
1-[4-(cyanomethylamino)-5-[(E)-hydroxyiminomethyl]-2-pyridinyl]pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 170737644
1-[5-(1,2-oxazol-5-yl)-4-(propan-2-ylamino)-2-pyridinyl]pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 139334151
4-(2-amino-6-methylimidazo[4,5-b]pyridin-3-yl)benzonitrile
CID 79301752
3-(4-methylphenyl)triazolo[1,5-a]pyrimidine-6-carbonitrile
CID 105495917

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile?
The IUPAC name of 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile (CID 115040096) is 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile.
What is the SMILES notation for 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile?
The canonical SMILES for 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile is Cc1ccc(-n2ncc3cc(C#N)cnc32)cc1.
What is the InChIKey of 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile?
The InChIKey is NWAWUWYXBYHIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-10-2-4-13(5-3-10)18-14-12(9-17-18)6-11(7-15)8-16-14/h2-6,8-9H,1H3.
What are the key properties of 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile?
1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile has a molecular weight of 234.26 g/mol, XLogP of 2.60, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile is sourced from PubChem (CID 115040096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).