5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile

C18H11N5 — CID 82220280

IUPAC5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile
SMILESN#Cc1cc(-c2ccccn2)n(-c2cccc3cccnc23)n1
InChIInChI=1S/C18H11N5/c19-12-14-11-17(15-7-1-2-9-20-15)23(22-14)16-8-3-5-13-6-4-10-21-18(13)16/h1-11H
InChIKeyQLCPCHDYDTUIJX-UHFFFAOYSA-N
MW297.32 g/mol
LogP3.35
Rot. Bonds2

About 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile

5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile (PubChem CID 82220280) has the molecular formula C18H11N5 and a molecular weight of 297.32 g/mol. Its IUPAC name is 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile.

Molecular Properties

Compound Name5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile
PubChem CID82220280
Molecular FormulaC18H11N5
Molecular Weight297.32 g/mol
Exact Mass297.10
IUPAC Name5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile
SMILESN#Cc1cc(-c2ccccn2)n(-c2cccc3cccnc23)n1
InChIInChI=1S/C18H11N5/c19-12-14-11-17(15-7-1-2-9-20-15)23(22-14)16-8-3-5-13-6-4-10-21-18(13)16/h1-11H
InChIKeyQLCPCHDYDTUIJX-UHFFFAOYSA-N
XLogP3.35
TPSA67.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-methylphenyl)-5-pyridin-2-ylpyrazole-3-carbonitrile
CID 82220283
1-(3-methoxyphenyl)-5-pyridin-2-ylpyrazole-3-carbonitrile
CID 82220284
8-[3-(4-methoxyphenyl)-5-phenylpyrazol-1-yl]quinoline
CID 1205496
8-pyridin-2-ylquinoline
CID 10982041
1-(2-bromophenyl)-5-pyridin-3-ylpyrazole-3-carbonitrile
CID 82220249
2-pyridin-2-ylpyridine;quinolin-8-ol
CID 67892593
quinoline-8-carbonitrile;trihydrochloride
CID 141468212
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrimidin-2-ylpyrazole-3-carbonitrile
CID 39434702
6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-quinolin-8-ylcarbazole-3-carbonitrile
CID 118152689
3-quinolin-8-ylbenzonitrile
CID 4189045
4-(3,6-dipyridin-2-ylcarbazol-9-yl)pyridine-2,6-dicarbonitrile
CID 155332666
4-[3-[3-(1,10-phenanthrolin-2-yl)naphthalen-2-yl]naphthalen-2-yl]benzonitrile
CID 146654295

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile?
The IUPAC name of 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile (CID 82220280) is 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile.
What is the SMILES notation for 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile?
The canonical SMILES for 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile is N#Cc1cc(-c2ccccn2)n(-c2cccc3cccnc23)n1.
What is the InChIKey of 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile?
The InChIKey is QLCPCHDYDTUIJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11N5/c19-12-14-11-17(15-7-1-2-9-20-15)23(22-14)16-8-3-5-13-6-4-10-21-18(13)16/h1-11H.
What are the key properties of 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile?
5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile has a molecular weight of 297.32 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-yl-1-quinolin-8-ylpyrazole-3-carbonitrile is sourced from PubChem (CID 82220280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).