2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide

C23H18N4O2 — CID 109091249

IUPAC2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2cc(C(=O)Nc3cccc4cccnc34)ccn2)c1
InChIInChI=1S/C23H18N4O2/c1-15-5-2-8-18(13-15)26-23(29)20-14-17(10-12-24-20)22(28)27-19-9-3-6-16-7-4-11-25-21(16)19/h2-14H,1H3,(H,26,29)(H,27,28)
InChIKeyFSARELVQGHMWPZ-UHFFFAOYSA-N
MW382.42 g/mol
LogP4.44
Rot. Bonds4

About 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide

2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide (PubChem CID 109091249) has the molecular formula C23H18N4O2 and a molecular weight of 382.42 g/mol. Its IUPAC name is 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
PubChem CID109091249
Molecular FormulaC23H18N4O2
Molecular Weight382.42 g/mol
Exact Mass382.14
IUPAC Name2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2cc(C(=O)Nc3cccc4cccnc34)ccn2)c1
InChIInChI=1S/C23H18N4O2/c1-15-5-2-8-18(13-15)26-23(29)20-14-17(10-12-24-20)22(28)27-19-9-3-6-16-7-4-11-25-21(16)19/h2-14H,1H3,(H,26,29)(H,27,28)
InChIKeyFSARELVQGHMWPZ-UHFFFAOYSA-N
XLogP4.44
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(4-methoxyphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109093095
4-N-(2-tert-butylphenyl)-2-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091209
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109093313
4-N-(4-acetamidophenyl)-2-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091241
2-N-(3-fluorophenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091177
N-(3-methylphenyl)-3-[(E)-3-oxo-3-(quinolin-8-ylamino)prop-1-enyl]benzamide
CID 159458220
2-(3-methylanilino)-N-quinolin-8-ylpyrimidine-5-carboxamide
CID 109265647
2-methyl-6-(3-methylanilino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 112848249
2-N-(3,4-difluorophenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091189
2-N-(4-ethylphenyl)-4-N-(3-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091133
2-N-(3-methylphenyl)-4-N-[3-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
CID 109091236
N-(3-methylphenyl)quinoline-8-carboxamide
CID 30267656

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide (CID 109091249) is 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide is Cc1cccc(NC(=O)c2cc(C(=O)Nc3cccc4cccnc34)ccn2)c1.
What is the InChIKey of 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide?
The InChIKey is FSARELVQGHMWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2/c1-15-5-2-8-18(13-15)26-23(29)20-14-17(10-12-24-20)22(28)27-19-9-3-6-16-7-4-11-25-21(16)19/h2-14H,1H3,(H,26,29)(H,27,28).
What are the key properties of 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide?
2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide has a molecular weight of 382.42 g/mol, XLogP of 4.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methylphenyl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109091249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).