6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide

C24H20N4O2 — CID 109100392

IUPAC6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
SMILESCc1ccc(NC(=O)c2cccc(C(=O)Nc3cccc4cccnc34)n2)c(C)c1
InChIInChI=1S/C24H20N4O2/c1-15-11-12-18(16(2)14-15)27-23(29)20-9-4-10-21(26-20)24(30)28-19-8-3-6-17-7-5-13-25-22(17)19/h3-14H,1-2H3,(H,27,29)(H,28,30)
InChIKeyFJAOCJILNKJAOD-UHFFFAOYSA-N
MW396.45 g/mol
LogP4.75
Rot. Bonds4

About 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide

6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide (PubChem CID 109100392) has the molecular formula C24H20N4O2 and a molecular weight of 396.45 g/mol. Its IUPAC name is 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
PubChem CID109100392
Molecular FormulaC24H20N4O2
Molecular Weight396.45 g/mol
Exact Mass396.16
IUPAC Name6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
SMILESCc1ccc(NC(=O)c2cccc(C(=O)Nc3cccc4cccnc34)n2)c(C)c1
InChIInChI=1S/C24H20N4O2/c1-15-11-12-18(16(2)14-15)27-23(29)20-9-4-10-21(26-20)24(30)28-19-8-3-6-17-7-5-13-25-22(17)19/h3-14H,1-2H3,(H,27,29)(H,28,30)
InChIKeyFJAOCJILNKJAOD-UHFFFAOYSA-N
XLogP4.75
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.45
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-quinolin-8-ylpyridine-2-carboxamide
CID 62235243
1-(4-chloro-2-methylphenyl)-3-quinolin-8-ylurea
CID 108991844
1-(2,5-dimethylphenyl)-3-quinolin-8-ylurea
CID 48742637
6-N,6-N-diethyl-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
CID 109099049
quinolin-8-yl N-(2,4-dimethylphenyl)carbamate
CID 3307290
2-(2,5-dimethylanilino)-N-quinolin-8-ylpyrimidine-5-carboxamide
CID 109266661
2-(4-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109314065
N-(2,4-dimethylphenyl)pyridazine-3-carboxamide
CID 110857188
6-(dimethylamino)-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 84575312
6-methyl-2-(2-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109334786
2-N-[2-(dimethylamino)ethyl]-6-N-quinolin-8-ylpyridine-2,6-dicarboxamide
CID 109096405
2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109091249

Frequently Asked Questions

What is the IUPAC name of 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide (CID 109100392) is 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide is Cc1ccc(NC(=O)c2cccc(C(=O)Nc3cccc4cccnc34)n2)c(C)c1.
What is the InChIKey of 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide?
The InChIKey is FJAOCJILNKJAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O2/c1-15-11-12-18(16(2)14-15)27-23(29)20-9-4-10-21(26-20)24(30)28-19-8-3-6-17-7-5-13-25-22(17)19/h3-14H,1-2H3,(H,27,29)(H,28,30).
What are the key properties of 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide?
6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide has a molecular weight of 396.45 g/mol, XLogP of 4.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide is sourced from PubChem (CID 109100392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).