6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile

C17H18N6 — CID 91464759

IUPAC6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
SMILESN#CC1C(C2CCNCC2)=Nc2[nH]ncc2C1c1cccnc1
InChIInChI=1S/C17H18N6/c18-8-13-15(12-2-1-5-20-9-12)14-10-21-23-17(14)22-16(13)11-3-6-19-7-4-11/h1-2,5,9-11,13,15,19H,3-4,6-7H2,(H,21,23)
InChIKeyMDOAYOGRZTWQFB-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.16
Rot. Bonds2

About 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile

6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile (PubChem CID 91464759) has the molecular formula C17H18N6 and a molecular weight of 306.37 g/mol. Its IUPAC name is 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Name6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
PubChem CID91464759
Molecular FormulaC17H18N6
Molecular Weight306.37 g/mol
Exact Mass306.16
IUPAC Name6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
SMILESN#CC1C(C2CCNCC2)=Nc2[nH]ncc2C1c1cccnc1
InChIInChI=1S/C17H18N6/c18-8-13-15(12-2-1-5-20-9-12)14-10-21-23-17(14)22-16(13)11-3-6-19-7-4-11/h1-2,5,9-11,13,15,19H,3-4,6-7H2,(H,21,23)
InChIKeyMDOAYOGRZTWQFB-UHFFFAOYSA-N
XLogP2.16
TPSA89.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(1-methylpiperidin-4-yl)-4-phenyl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 90697067
4-(2,1,3-benzothiadiazol-4-yl)-6-piperidin-4-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 91234527
4-(2-bromo-3-cyanophenyl)-6-cyclopentyl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 91357529
3-piperidin-4-ylpyridine;dihydrochloride
CID 21192973
4-(2-bromo-3-cyanophenyl)-6-piperidin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 91082622
4-pyridin-3-ylazepane
CID 83262248
3-pyrrolidin-3-ylpyridine
CID 3613651
4-(2,1,3-benzoxadiazol-4-yl)-6-(1-ethylpiperidin-4-yl)-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 91146076
4-(2-bromo-3-cyanophenyl)-6-piperidin-2-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 91521605
9-pyridin-3-yl-4-azabicyclo[5.3.1]undecane
CID 57485548
N-[(1R,2S)-2-pyridin-3-ylcyclopropyl]piperidin-4-amine
CID 71522236
6-[(1S,4R,6R)-2-azabicyclo[2.2.2]octan-6-yl]-4-(2,1,3-benzoxadiazol-4-yl)-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 91312298

Frequently Asked Questions

What is the IUPAC name of 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile?
The IUPAC name of 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile (CID 91464759) is 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile.
What is the SMILES notation for 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile?
The canonical SMILES for 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile is N#CC1C(C2CCNCC2)=Nc2[nH]ncc2C1c1cccnc1.
What is the InChIKey of 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile?
The InChIKey is MDOAYOGRZTWQFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6/c18-8-13-15(12-2-1-5-20-9-12)14-10-21-23-17(14)22-16(13)11-3-6-19-7-4-11/h1-2,5,9-11,13,15,19H,3-4,6-7H2,(H,21,23).
What are the key properties of 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile?
6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile has a molecular weight of 306.37 g/mol, XLogP of 2.16, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-4-yl-4-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[5,4-b]pyridine-5-carbonitrile is sourced from PubChem (CID 91464759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).