2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide

C21H19N3O2 — CID 109090820

IUPAC2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cc(C(=O)Nc2ccccc2)ccn1
InChIInChI=1S/C21H19N3O2/c1-2-15-8-6-7-11-18(15)24-21(26)19-14-16(12-13-22-19)20(25)23-17-9-4-3-5-10-17/h3-14H,2H2,1H3,(H,23,25)(H,24,26)
InChIKeyAARQWJQVWRRUME-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.15
Rot. Bonds5

About 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide

2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide (PubChem CID 109090820) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
PubChem CID109090820
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cc(C(=O)Nc2ccccc2)ccn1
InChIInChI=1S/C21H19N3O2/c1-2-15-8-6-7-11-18(15)24-21(26)19-14-16(12-13-22-19)20(25)23-17-9-4-3-5-10-17/h3-14H,2H2,1H3,(H,23,25)(H,24,26)
InChIKeyAARQWJQVWRRUME-UHFFFAOYSA-N
XLogP4.15
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092181
4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092240
2-N-(3-acetylphenyl)-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092202
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
4-N-(2,3-dimethylphenyl)-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092107
2-N-tert-butyl-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109089264
4-N-(2-ethylphenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087638
2-N-[3-(dimethylamino)propyl]-4-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109084067
4-N-benzyl-2-N-(2-ethylphenyl)-4-N-methylpyridine-2,4-dicarboxamide
CID 109086209
N-(2-ethylphenyl)-2-fluoropyridine-4-carboxamide
CID 61294713
2-N-[(2-chlorophenyl)methyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109086683
2-N-(3-acetylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090859

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide (CID 109090820) is 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide is CCc1ccccc1NC(=O)c1cc(C(=O)Nc2ccccc2)ccn1.
What is the InChIKey of 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
The InChIKey is AARQWJQVWRRUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-2-15-8-6-7-11-18(15)24-21(26)19-14-16(12-13-22-19)20(25)23-17-9-4-3-5-10-17/h3-14H,2H2,1H3,(H,23,25)(H,24,26).
What are the key properties of 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide has a molecular weight of 345.40 g/mol, XLogP of 4.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109090820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).