4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile

C14H10N4 — CID 18716383

IUPAC4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile
SMILESCc1c(-c2ccccn2)nc(C#N)c(C#N)c1C
InChIInChI=1S/C14H10N4/c1-9-10(2)14(12-5-3-4-6-17-12)18-13(8-16)11(9)7-15/h3-6H,1-2H3
InChIKeyYKFNIEWUBVYHAA-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.50
Rot. Bonds1

About 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile

4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile (PubChem CID 18716383) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile.

Molecular Properties

Compound Name4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile
PubChem CID18716383
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile
SMILESCc1c(-c2ccccn2)nc(C#N)c(C#N)c1C
InChIInChI=1S/C14H10N4/c1-9-10(2)14(12-5-3-4-6-17-12)18-13(8-16)11(9)7-15/h3-6H,1-2H3
InChIKeyYKFNIEWUBVYHAA-UHFFFAOYSA-N
XLogP2.50
TPSA73.36 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 ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dibromo-4,5-dimethyl-6-pyridin-2-ylpyridine
CID 54330183
ethyl 3-cyano-5,6-dipyridin-2-ylpyrazine-2-carboximidate
CID 101247882
3,4,5-trimethyl-6-pyridin-2-ylpyridazine
CID 152648665
2-(dimethylamino)-4-pyridin-2-ylpyrimidine-5-carbonitrile
CID 73439061
2-methyl-4-phenyl-3-pyridin-2-ylbenzonitrile
CID 156678731
7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile
CID 25022674
5,8-dimethyl-2,3-dipyridin-2-ylquinoxaline
CID 21026689
2-amino-6-(4-methylphenyl)-4-pyridin-2-ylpyridine-3-carbonitrile
CID 3365204
2-(2,4,6-trimethyl-3-pyridin-2-ylphenyl)pyridine
CID 140909024
1-methylisoquinoline-3,4-dicarbonitrile
CID 89141379
4-[4-(dimethylamino)phenyl]-2-phenyl-6-pyridin-2-ylpyridine-3-carbonitrile
CID 101490789
1-methyl-2-oxo-4-pyridin-2-ylpyrimidine-5-carbonitrile
CID 116851964

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile?
The IUPAC name of 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile (CID 18716383) is 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile.
What is the SMILES notation for 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile?
The canonical SMILES for 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile is Cc1c(-c2ccccn2)nc(C#N)c(C#N)c1C.
What is the InChIKey of 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile?
The InChIKey is YKFNIEWUBVYHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-9-10(2)14(12-5-3-4-6-17-12)18-13(8-16)11(9)7-15/h3-6H,1-2H3.
What are the key properties of 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile?
4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile has a molecular weight of 234.26 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile is sourced from PubChem (CID 18716383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).