2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid

C23H20N2O2 — CID 67850810

IUPAC2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid
SMILESCC1=C(C(=O)O)C(c2cccc3ccccc23)C(c2ccccn2)=C(C)N1
InChIInChI=1S/C23H20N2O2/c1-14-20(19-12-5-6-13-24-19)22(21(23(26)27)15(2)25-14)18-11-7-9-16-8-3-4-10-17(16)18/h3-13,22,25H,1-2H3,(H,26,27)
InChIKeyXKXQONPJIARZNX-UHFFFAOYSA-N
MW356.43 g/mol
LogP4.71
Rot. Bonds3

About 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid

2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid (PubChem CID 67850810) has the molecular formula C23H20N2O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid.

Molecular Properties

Compound Name2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid
PubChem CID67850810
Molecular FormulaC23H20N2O2
Molecular Weight356.43 g/mol
Exact Mass356.15
IUPAC Name2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid
SMILESCC1=C(C(=O)O)C(c2cccc3ccccc23)C(c2ccccn2)=C(C)N1
InChIInChI=1S/C23H20N2O2/c1-14-20(19-12-5-6-13-24-19)22(21(23(26)27)15(2)25-14)18-11-7-9-16-8-3-4-10-17(16)18/h3-13,22,25H,1-2H3,(H,26,27)
InChIKeyXKXQONPJIARZNX-UHFFFAOYSA-N
XLogP4.71
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

5-methoxycarbonyl-2,6-dimethyl-4-quinolin-4-yl-1,4-dihydropyridine-3-carboxylic acid
CID 67842681
7-methyl-5-naphthalen-1-yl-5,6-dihydroimidazo[1,2-a]pyrimidine-6-carboxylic acid
CID 91507303
4-(2-butoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 173370763
2,6-dimethyl-4-(2-methylsulfinylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 21422156
4-[2-(acetyloxymethyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 70457655
2-phenylethyl (4S)-2-methyl-4-naphthalen-1-yl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
CID 1372666
methyl (4R)-6-methyl-4-naphthalen-1-yl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 793251
(5-carboxyoxy-2,6-dimethyl-4-pyridin-2-yl-1,4-dihydropyridin-3-yl) ethyl carbonate
CID 70570530
2,6-dimethyl-4-[2-(2-phenylethynyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 23038910
4-(2,6-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 139677595
4-[2-[(3,4-dichlorophenyl)methoxy]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 150053756
4-[2-[(2-chlorophenyl)methoxy]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid
CID 150921349

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid?
The IUPAC name of 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid (CID 67850810) is 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid.
What is the SMILES notation for 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid?
The canonical SMILES for 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid is CC1=C(C(=O)O)C(c2cccc3ccccc23)C(c2ccccn2)=C(C)N1.
What is the InChIKey of 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid?
The InChIKey is XKXQONPJIARZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2/c1-14-20(19-12-5-6-13-24-19)22(21(23(26)27)15(2)25-14)18-11-7-9-16-8-3-4-10-17(16)18/h3-13,22,25H,1-2H3,(H,26,27).
What are the key properties of 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid?
2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid has a molecular weight of 356.43 g/mol, XLogP of 4.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-naphthalen-1-yl-5-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid is sourced from PubChem (CID 67850810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).