6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile

C15H14N2O — CID 82453336

IUPAC6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile
SMILESCOc1ccc(C)cc1-c1ccc(C#N)c(C)n1
InChIInChI=1S/C15H14N2O/c1-10-4-7-15(18-3)13(8-10)14-6-5-12(9-16)11(2)17-14/h4-8H,1-3H3
InChIKeyJOXLSKOQBPLNCD-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.25
Rot. Bonds2

About 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile

6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile (PubChem CID 82453336) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile
PubChem CID82453336
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile
SMILESCOc1ccc(C)cc1-c1ccc(C#N)c(C)n1
InChIInChI=1S/C15H14N2O/c1-10-4-7-15(18-3)13(8-10)14-6-5-12(9-16)11(2)17-14/h4-8H,1-3H3
InChIKeyJOXLSKOQBPLNCD-UHFFFAOYSA-N
XLogP3.25
TPSA45.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dimethylamino)-6-(5-fluoro-2-methoxyphenyl)pyridine-3-carbonitrile
CID 94280993
4-(2-methoxy-5-methylphenyl)-2,6-dimethylpyrimidine
CID 116896903
3-[4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-2-yl]propanenitrile
CID 116895108
4-(2-methoxy-5-methylphenyl)-6-methylpyrimidin-2-amine
CID 62482749
6-(2-methoxy-5-methylphenyl)-5-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 82120107
4-methoxy-6-(2-methoxy-5-methylphenyl)pyrimidin-2-amine
CID 114052966
3-(2-methoxy-5-methylphenyl)benzonitrile
CID 39245698
5-(2-methoxy-5-methylphenyl)-1,2-thiazol-3-amine
CID 83910475
2-[5,6-bis(dimethylamino)-2-pyridinyl]-4-methylbenzonitrile
CID 123987139
3-amino-4-(2-methoxy-5-methylphenyl)-5-methylthiophene-2-carbonitrile
CID 82121012
4-chloro-6-(2-methoxy-5-methylphenyl)-2-propan-2-ylpyrimidine
CID 80952524
6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 56701713

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile?
The IUPAC name of 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile (CID 82453336) is 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile.
What is the SMILES notation for 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile?
The canonical SMILES for 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile is COc1ccc(C)cc1-c1ccc(C#N)c(C)n1.
What is the InChIKey of 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile?
The InChIKey is JOXLSKOQBPLNCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-10-4-7-15(18-3)13(8-10)14-6-5-12(9-16)11(2)17-14/h4-8H,1-3H3.
What are the key properties of 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile?
6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile has a molecular weight of 238.29 g/mol, XLogP of 3.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxy-5-methylphenyl)-2-methylpyridine-3-carbonitrile is sourced from PubChem (CID 82453336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).