2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile

C16H17N3 — CID 82119532

IUPAC2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile
SMILESCc1ccc(-c2ccc(C#N)c(N(C)C)n2)c(C)c1
InChIInChI=1S/C16H17N3/c1-11-5-7-14(12(2)9-11)15-8-6-13(10-17)16(18-15)19(3)4/h5-9H,1-4H3
InChIKeyGLWAIEWKDQIXFV-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.30
Rot. Bonds2

About 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile

2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile (PubChem CID 82119532) has the molecular formula C16H17N3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile
PubChem CID82119532
Molecular FormulaC16H17N3
Molecular Weight251.33 g/mol
Exact Mass251.14
IUPAC Name2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile
SMILESCc1ccc(-c2ccc(C#N)c(N(C)C)n2)c(C)c1
InChIInChI=1S/C16H17N3/c1-11-5-7-14(12(2)9-11)15-8-6-13(10-17)16(18-15)19(3)4/h5-9H,1-4H3
InChIKeyGLWAIEWKDQIXFV-UHFFFAOYSA-N
XLogP3.30
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5,6-bis(dimethylamino)-2-pyridinyl]-4-methylbenzonitrile
CID 123987139
2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid
CID 82123788
2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile
CID 94280993
[6-(2,4-dimethylphenyl)pyridazin-3-yl]-methylcyanamide
CID 116973781
6-chloro-2-(dimethylamino)pyridine-3-carbonitrile
CID 178072823
2-(dimethylamino)-6-(4-ethylphenyl)pyridine-3-carbonitrile
CID 82119527
6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane
CID 176948420
4-methyl-2-(N,2,4-trimethylanilino)benzonitrile
CID 63511662
2-(dimethylamino)-6-(4-propylphenyl)pyridine-3-carbonitrile
CID 82122654
6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile
CID 82453336
2-bromo-4-(2,4-dimethylphenyl)pyrimidine
CID 116904235
4-methyl-2-[2-methylpropyl(propan-2-yl)amino]benzonitrile
CID 62303808

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile?
The IUPAC name of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile (CID 82119532) is 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile?
The canonical SMILES for 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile is Cc1ccc(-c2ccc(C#N)c(N(C)C)n2)c(C)c1.
What is the InChIKey of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile?
The InChIKey is GLWAIEWKDQIXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3/c1-11-5-7-14(12(2)9-11)15-8-6-13(10-17)16(18-15)19(3)4/h5-9H,1-4H3.
What are the key properties of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile?
2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile has a molecular weight of 251.33 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile is sourced from PubChem (CID 82119532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).