6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile

C12H11N5 — CID 118188991

IUPAC6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-n2ncc3c2CCNC3)nc1
InChIInChI=1S/C12H11N5/c13-5-9-1-2-12(15-6-9)17-11-3-4-14-7-10(11)8-16-17/h1-2,6,8,14H,3-4,7H2
InChIKeyZJNUKHCZVSEBMT-UHFFFAOYSA-N
MW225.25 g/mol
LogP0.78
Rot. Bonds1

About 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile

6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile (PubChem CID 118188991) has the molecular formula C12H11N5 and a molecular weight of 225.25 g/mol. Its IUPAC name is 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile
PubChem CID118188991
Molecular FormulaC12H11N5
Molecular Weight225.25 g/mol
Exact Mass225.10
IUPAC Name6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-n2ncc3c2CCNC3)nc1
InChIInChI=1S/C12H11N5/c13-5-9-1-2-12(15-6-9)17-11-3-4-14-7-10(11)8-16-17/h1-2,6,8,14H,3-4,7H2
InChIKeyZJNUKHCZVSEBMT-UHFFFAOYSA-N
XLogP0.78
TPSA66.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,5-dioxopyrrolidin-1-yl)pyridine-3-carbonitrile
CID 71813200
(4,4-difluoropiperidin-1-yl)-[6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)-3-pyridinyl]methanone;N,N-dimethylcarbamoyl chloride;ethane
CID 168987913
3-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)aniline
CID 105467862
6-[5-[(1S)-1-aminoethyl]-1,2,4-triazol-1-yl]pyridine-3-carbonitrile
CID 155676495
3-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)benzoic acid
CID 82586390
6-(5-morpholin-3-yl-1,2,4-triazol-1-yl)pyridine-3-carbonitrile;hydrochloride
CID 170637703
6-(2,2-dimethylpiperazin-1-yl)pyridine-3-carbonitrile;hydrochloride
CID 67324559
6-(4-chloro-3,5-dimethylpyrazol-1-yl)pyridine-3-carbonitrile
CID 62129175
6-(4-piperidin-4-yloxypiperidin-1-yl)pyridine-3-carbonitrile
CID 69354590
1-(2,2,2-trifluoroethyl)-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine;hydrochloride
CID 162423020
1-phenyl-5,6,7,8-tetrahydro-4H-pyrazolo[4,5-d]azepine
CID 84679841
6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile
CID 166214209

Frequently Asked Questions

What is the IUPAC name of 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile?
The IUPAC name of 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile (CID 118188991) is 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile is N#Cc1ccc(-n2ncc3c2CCNC3)nc1.
What is the InChIKey of 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile?
The InChIKey is ZJNUKHCZVSEBMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5/c13-5-9-1-2-12(15-6-9)17-11-3-4-14-7-10(11)8-16-17/h1-2,6,8,14H,3-4,7H2.
What are the key properties of 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile?
6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile has a molecular weight of 225.25 g/mol, XLogP of 0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5,6,7-tetrahydropyrazolo[4,5-c]pyridin-1-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 118188991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).