2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile

C15H16N4 — CID 81060354

IUPAC2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile
SMILESCc1cc(NCCc2ccncc2)c(C#N)c(C)n1
InChIInChI=1S/C15H16N4/c1-11-9-15(14(10-16)12(2)19-11)18-8-5-13-3-6-17-7-4-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,18,19)
InChIKeyAAOKCMFWPFUMRV-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.62
Rot. Bonds4

About 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile

2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile (PubChem CID 81060354) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile
PubChem CID81060354
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile
SMILESCc1cc(NCCc2ccncc2)c(C#N)c(C)n1
InChIInChI=1S/C15H16N4/c1-11-9-15(14(10-16)12(2)19-11)18-8-5-13-3-6-17-7-4-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,18,19)
InChIKeyAAOKCMFWPFUMRV-UHFFFAOYSA-N
XLogP2.62
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-4-(2-thiophen-2-ylethylamino)pyridine-3-carbonitrile
CID 81042656
2,6-dimethyl-4-[2-(1-methylpyrazol-4-yl)ethylamino]pyridine-3-carbonitrile
CID 81060304
2,6-dimethyl-4-(3-methylbutylamino)pyridine-3-carbonitrile
CID 81042476
4-[2-(2,4-dichlorophenyl)ethylamino]-2,6-dimethylpyridine-3-carbonitrile
CID 81061197
2,6-dimethyl-4-[2-(1H-1,2,4-triazol-5-yl)ethylamino]pyridine-3-carbonitrile
CID 81052464
4-[2-(cyclopenten-1-yl)ethylamino]-2,6-dimethylpyridine-3-carbonitrile
CID 103844191
2,6-dimethyl-4-[(3-methylphenyl)methylamino]pyridine-3-carbonitrile
CID 81060441
2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile
CID 81060922
4,6-dimethyl-2-(2-phenylethylamino)pyridine-3-carbonitrile
CID 32677882
4-[3-(cyclopropylamino)propylamino]-2,6-dimethylpyridine-3-carbonitrile
CID 81052089
methyl 3-[(3-cyano-2,6-dimethyl-4-pyridinyl)amino]propanoate
CID 81061329
4-(3-ethoxypropylamino)-2,6-dimethylpyridine-3-carbonitrile
CID 81061309

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
The IUPAC name of 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile (CID 81060354) is 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile.
What is the SMILES notation for 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
The canonical SMILES for 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile is Cc1cc(NCCc2ccncc2)c(C#N)c(C)n1.
What is the InChIKey of 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
The InChIKey is AAOKCMFWPFUMRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-11-9-15(14(10-16)12(2)19-11)18-8-5-13-3-6-17-7-4-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,18,19).
What are the key properties of 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile?
2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile has a molecular weight of 252.32 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(2-pyridin-4-ylethylamino)pyridine-3-carbonitrile is sourced from PubChem (CID 81060354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).