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

C21H19N3O3 — CID 109090848

IUPAC2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(C(=O)Nc2ccccc2)ccn1
InChIInChI=1S/C21H19N3O3/c1-2-27-19-11-7-6-10-17(19)24-21(26)18-14-15(12-13-22-18)20(25)23-16-8-4-3-5-9-16/h3-14H,2H2,1H3,(H,23,25)(H,24,26)
InChIKeyAABFWSBRJFIPAZ-UHFFFAOYSA-N
MW361.40 g/mol
LogP3.98
Rot. Bonds6

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

2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide (PubChem CID 109090848) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
PubChem CID109090848
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC Name2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
SMILESCCOc1ccccc1NC(=O)c1cc(C(=O)Nc2ccccc2)ccn1
InChIInChI=1S/C21H19N3O3/c1-2-27-19-11-7-6-10-17(19)24-21(26)18-14-15(12-13-22-18)20(25)23-16-8-4-3-5-9-16/h3-14H,2H2,1H3,(H,23,25)(H,24,26)
InChIKeyAABFWSBRJFIPAZ-UHFFFAOYSA-N
XLogP3.98
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2-ethoxyphenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092650
4-N-(4-ethoxyphenyl)-2-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093012
2-N-(2-ethylphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090820
4-N-(2-ethoxyphenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087665
2-N-(2-ethoxyphenyl)-4-N-ethyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109092343
2-N-(2-chlorophenyl)-4-N-(4-ethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092798
4-N-(2-ethoxyphenyl)-2-N,2-N-dipropylpyridine-2,4-dicarboxamide
CID 109090577
2-N-(2-ethoxyphenyl)-4-N-[(4-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085904
4-N-(2-ethoxyphenyl)-2-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085231
4-N-(2-ethoxyphenyl)-2-N-[(2-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086463
N-(2-ethoxyphenyl)-4-(propylamino)pyridine-2-carboxamide
CID 109201237
2-N-(2,5-dimethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090853

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide (CID 109090848) is 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide is CCOc1ccccc1NC(=O)c1cc(C(=O)Nc2ccccc2)ccn1.
What is the InChIKey of 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
The InChIKey is AABFWSBRJFIPAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c1-2-27-19-11-7-6-10-17(19)24-21(26)18-14-15(12-13-22-18)20(25)23-16-8-4-3-5-9-16/h3-14H,2H2,1H3,(H,23,25)(H,24,26).
What are the key properties of 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide?
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide has a molecular weight of 361.40 g/mol, XLogP of 3.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109090848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).