4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide

C23H24N4O2 — CID 109092240

IUPAC4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cc(C(=O)Nc2ccc(N(C)C)cc2)ccn1
InChIInChI=1S/C23H24N4O2/c1-4-16-7-5-6-8-20(16)26-23(29)21-15-17(13-14-24-21)22(28)25-18-9-11-19(12-10-18)27(2)3/h5-15H,4H2,1-3H3,(H,25,28)(H,26,29)
InChIKeyRAYPNBYVYCPTJJ-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.21
Rot. Bonds6

About 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide

4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092240) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092240
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1cc(C(=O)Nc2ccc(N(C)C)cc2)ccn1
InChIInChI=1S/C23H24N4O2/c1-4-16-7-5-6-8-20(16)26-23(29)21-15-17(13-14-24-21)22(28)25-18-9-11-19(12-10-18)27(2)3/h5-15H,4H2,1-3H3,(H,25,28)(H,26,29)
InChIKeyRAYPNBYVYCPTJJ-UHFFFAOYSA-N
XLogP4.21
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide (CID 109092240) is 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide is CCc1ccccc1NC(=O)c1cc(C(=O)Nc2ccc(N(C)C)cc2)ccn1.
What is the InChIKey of 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is RAYPNBYVYCPTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-4-16-7-5-6-8-20(16)26-23(29)21-15-17(13-14-24-21)22(28)25-18-9-11-19(12-10-18)27(2)3/h5-15H,4H2,1-3H3,(H,25,28)(H,26,29).
What are the key properties of 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide?
4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[4-(dimethylamino)phenyl]-2-N-(2-ethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).