2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide

C21H19N3O3 — CID 109091016

IUPAC2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cc(C(=O)Nc3ccccc3C)ccn2)c1
InChIInChI=1S/C21H19N3O3/c1-14-6-3-4-9-18(14)24-20(25)15-10-11-22-19(12-15)21(26)23-16-7-5-8-17(13-16)27-2/h3-13H,1-2H3,(H,23,26)(H,24,25)
InChIKeyBQUKTAYZPSKQRR-UHFFFAOYSA-N
MW361.40 g/mol
LogP3.90
Rot. Bonds5

About 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide

2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109091016) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109091016
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC Name2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cc(C(=O)Nc3ccccc3C)ccn2)c1
InChIInChI=1S/C21H19N3O3/c1-14-6-3-4-9-18(14)24-20(25)15-10-11-22-19(12-15)21(26)23-16-7-5-8-17(13-16)27-2/h3-13H,1-2H3,(H,23,26)(H,24,25)
InChIKeyBQUKTAYZPSKQRR-UHFFFAOYSA-N
XLogP3.90
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide (CID 109091016) is 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide is COc1cccc(NC(=O)c2cc(C(=O)Nc3ccccc3C)ccn2)c1.
What is the InChIKey of 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is BQUKTAYZPSKQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c1-14-6-3-4-9-18(14)24-20(25)15-10-11-22-19(12-15)21(26)23-16-7-5-8-17(13-16)27-2/h3-13H,1-2H3,(H,23,26)(H,24,25).
What are the key properties of 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide?
2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 361.40 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109091016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).