2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid

C16H18N2O2 — CID 82123788

IUPAC2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid
SMILESCc1ccc(-c2ccc(C(=O)O)c(N(C)C)n2)c(C)c1
InChIInChI=1S/C16H18N2O2/c1-10-5-6-12(11(2)9-10)14-8-7-13(16(19)20)15(17-14)18(3)4/h5-9H,1-4H3,(H,19,20)
InChIKeyRDFKOHPJXOGGLT-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.13
Rot. Bonds3

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

2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid (PubChem CID 82123788) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid
PubChem CID82123788
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid
SMILESCc1ccc(-c2ccc(C(=O)O)c(N(C)C)n2)c(C)c1
InChIInChI=1S/C16H18N2O2/c1-10-5-6-12(11(2)9-10)14-8-7-13(16(19)20)15(17-14)18(3)4/h5-9H,1-4H3,(H,19,20)
InChIKeyRDFKOHPJXOGGLT-UHFFFAOYSA-N
XLogP3.13
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carbonitrile
CID 82119532
6-(2,5-dimethoxyphenyl)-2-(dimethylamino)pyridine-3-carboxylic acid
CID 94313799
6-(2,4-dimethylphenyl)-2-methylpyridine-3-carboximidamide
CID 82452571
6-tert-butyl-2-(2,4-dimethylphenyl)quinoline-4-carboxylic acid
CID 3921537
6-(2,4-dimethylphenyl)-2,3-dimethylpyridine;ethane
CID 176948420
2-(2,4-dimethylphenyl)-N,N-bis(2-methylpropyl)quinoline-4-carboxamide
CID 4119732
7-acetamido-2-(2,4-dimethylphenyl)quinoline-4-carboxylic acid
CID 18073634
6-(2,4-dimethylphenyl)imidazo[1,2-b]pyridazine-3-carboxylic acid
CID 116854355
2-methyl-6-(2-methylphenyl)pyridine-3-carboxylic acid
CID 112561990
5-bromo-2-(2,4-dimethylphenyl)benzoic acid
CID 114032341
2-(dimethylamino)-5-methyl-6-phenylpyridine-3-carboxylic acid
CID 82120489
[2-[methyl(propan-2-yl)amino]-2-oxoethyl] 2-(2,4-dimethylphenyl)quinoline-4-carboxylate
CID 55400967

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid?
The IUPAC name of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid (CID 82123788) is 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid?
The canonical SMILES for 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid is Cc1ccc(-c2ccc(C(=O)O)c(N(C)C)n2)c(C)c1.
What is the InChIKey of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid?
The InChIKey is RDFKOHPJXOGGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-10-5-6-12(11(2)9-10)14-8-7-13(16(19)20)15(17-14)18(3)4/h5-9H,1-4H3,(H,19,20).
What are the key properties of 2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid?
2-(dimethylamino)-6-(2,4-dimethylphenyl)pyridine-3-carboxylic acid has a molecular weight of 270.33 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 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-carboxylic acid is sourced from PubChem (CID 82123788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).