2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide

C23H23N3O2 — CID 109092181

IUPAC2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1ccnc(C(=O)Nc2ccccc2CC)c1
InChIInChI=1S/C23H23N3O2/c1-3-16-9-5-7-11-19(16)25-22(27)18-13-14-24-21(15-18)23(28)26-20-12-8-6-10-17(20)4-2/h5-15H,3-4H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyUEADGOPMDYWROA-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.71
Rot. Bonds6

About 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide

2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092181) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092181
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC Name2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
SMILESCCc1ccccc1NC(=O)c1ccnc(C(=O)Nc2ccccc2CC)c1
InChIInChI=1S/C23H23N3O2/c1-3-16-9-5-7-11-19(16)25-22(27)18-13-14-24-21(15-18)23(28)26-20-12-8-6-10-17(20)4-2/h5-15H,3-4H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyUEADGOPMDYWROA-UHFFFAOYSA-N
XLogP4.71
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide (CID 109092181) is 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide is CCc1ccccc1NC(=O)c1ccnc(C(=O)Nc2ccccc2CC)c1.
What is the InChIKey of 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is UEADGOPMDYWROA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-3-16-9-5-7-11-19(16)25-22(27)18-13-14-24-21(15-18)23(28)26-20-12-8-6-10-17(20)4-2/h5-15H,3-4H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide?
2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 373.46 g/mol, XLogP of 4.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).