2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide

C23H23N3O2 — CID 109092030

IUPAC2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2cc(C(=O)Nc3c(C)cccc3C)ccn2)c1C
InChIInChI=1S/C23H23N3O2/c1-14-7-6-10-19(17(14)4)25-23(28)20-13-18(11-12-24-20)22(27)26-21-15(2)8-5-9-16(21)3/h5-13H,1-4H3,(H,25,28)(H,26,27)
InChIKeyXGJVFAYNXJKUQO-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.82
Rot. Bonds4

About 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide

2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092030) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092030
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
SMILESCc1cccc(NC(=O)c2cc(C(=O)Nc3c(C)cccc3C)ccn2)c1C
InChIInChI=1S/C23H23N3O2/c1-14-7-6-10-19(17(14)4)25-23(28)20-13-18(11-12-24-20)22(27)26-21-15(2)8-5-9-16(21)3/h5-13H,1-4H3,(H,25,28)(H,26,27)
InChIKeyXGJVFAYNXJKUQO-UHFFFAOYSA-N
XLogP4.82
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide (CID 109092030) is 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide is Cc1cccc(NC(=O)c2cc(C(=O)Nc3c(C)cccc3C)ccn2)c1C.
What is the InChIKey of 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is XGJVFAYNXJKUQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-14-7-6-10-19(17(14)4)25-23(28)20-13-18(11-12-24-20)22(27)26-21-15(2)8-5-9-16(21)3/h5-13H,1-4H3,(H,25,28)(H,26,27).
What are the key properties of 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide?
2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 373.46 g/mol, XLogP of 4.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).