3,5-dipyridin-3-ylpyridine-4-carbonitrile

C16H10N4 — CID 46316354

IUPAC3,5-dipyridin-3-ylpyridine-4-carbonitrile
SMILESN#Cc1c(-c2cccnc2)cncc1-c1cccnc1
InChIInChI=1S/C16H10N4/c17-7-14-15(12-3-1-5-18-8-12)10-20-11-16(14)13-4-2-6-19-9-13/h1-6,8-11H
InChIKeyJVELERYGZKLLOH-UHFFFAOYSA-N
MW258.28 g/mol
LogP3.08
Rot. Bonds2

About 3,5-dipyridin-3-ylpyridine-4-carbonitrile

3,5-dipyridin-3-ylpyridine-4-carbonitrile (PubChem CID 46316354) has the molecular formula C16H10N4 and a molecular weight of 258.28 g/mol. Its IUPAC name is 3,5-dipyridin-3-ylpyridine-4-carbonitrile.

Molecular Properties

Compound Name3,5-dipyridin-3-ylpyridine-4-carbonitrile
PubChem CID46316354
Molecular FormulaC16H10N4
Molecular Weight258.28 g/mol
Exact Mass258.09
IUPAC Name3,5-dipyridin-3-ylpyridine-4-carbonitrile
SMILESN#Cc1c(-c2cccnc2)cncc1-c1cccnc1
InChIInChI=1S/C16H10N4/c17-7-14-15(12-3-1-5-18-8-12)10-20-11-16(14)13-4-2-6-19-9-13/h1-6,8-11H
InChIKeyJVELERYGZKLLOH-UHFFFAOYSA-N
XLogP3.08
TPSA62.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-difluoro-3-pyridin-3-ylbenzonitrile
CID 58731401
2-pyridin-3-ylnaphthalene-1-carbonitrile
CID 71514388
3-chloro-5-pyridin-3-yl-1,2-thiazole-4-carbonitrile
CID 86767902
2,5-dipyridin-3-ylbenzonitrile
CID 46316425
1,6-dimethyl-2-oxo-4-pyridin-3-ylpyridine-3-carbonitrile
CID 82080782
4-fluoro-2-pyridin-3-ylbenzonitrile
CID 46315558
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
1,2,5-trimethyl-4-pyridin-3-ylpyrrole-3-carbonitrile
CID 121495989
4-methyl-5-pyridin-3-ylpyridin-3-ol
CID 175581528
2-amino-6-(2-bromophenyl)-4-pyridin-3-ylpyridine-3-carbonitrile
CID 5117531
3-bromo-4-hydroxy-5-pyridin-3-ylbenzonitrile
CID 167329027
3-(4-pyridin-3-ylthiophen-3-yl)pyridine
CID 46316707

Frequently Asked Questions

What is the IUPAC name of 3,5-dipyridin-3-ylpyridine-4-carbonitrile?
The IUPAC name of 3,5-dipyridin-3-ylpyridine-4-carbonitrile (CID 46316354) is 3,5-dipyridin-3-ylpyridine-4-carbonitrile.
What is the SMILES notation for 3,5-dipyridin-3-ylpyridine-4-carbonitrile?
The canonical SMILES for 3,5-dipyridin-3-ylpyridine-4-carbonitrile is N#Cc1c(-c2cccnc2)cncc1-c1cccnc1.
What is the InChIKey of 3,5-dipyridin-3-ylpyridine-4-carbonitrile?
The InChIKey is JVELERYGZKLLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N4/c17-7-14-15(12-3-1-5-18-8-12)10-20-11-16(14)13-4-2-6-19-9-13/h1-6,8-11H.
What are the key properties of 3,5-dipyridin-3-ylpyridine-4-carbonitrile?
3,5-dipyridin-3-ylpyridine-4-carbonitrile has a molecular weight of 258.28 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dipyridin-3-ylpyridine-4-carbonitrile is sourced from PubChem (CID 46316354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).